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3-[(Z)-(3-ISOPROPYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)METHYL]-9-METHYL-2-(PHENYLSULFANYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE structure
Fine Chemical

3-[(Z)-(3-ISOPROPYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)METHYL]-9-METHYL-2-(PHENYLSULFANYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE

TL;DR: 3-[(Z)-(3-ISOPROPYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)METHYL]-9-METHYL-2-(PHENYLSULFANYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE (CAS 608491-01-6) is a chemical compound with molecular formula C22H19N3O2S3 and molecular weight 453.06393 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(5Z)-5-[(9-methyl-4-oxo-2-phenylsulfanylpyrido[1,2-a]pyrimidin-3-yl)methylidene]-3-propan-2-yl-2-sulfanylidene-1,3-thiazolidin-4-one

Also Known As: 3-[(Z)-(3-ISOPROPYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)METHYL]-9-METHYL-2-(PHENYLSULFANYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE, (Z)-3-isopropyl-5-((9-methyl-4-oxo-2-(phenylthio)-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-2-thioxothiazolidin-4-one, (5Z)-5-[(9-methyl-4-oxo-2-phenylsulfanylpyrido[1,2-a]pyrimidin-3-yl)methylidene]-3-propan-2-yl-2-sulfanylidene-1,3-thiazolidin-4-one, (5Z)-5-{[9-METHYL-4-OXO-2-(PHENYLSULFANYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-3-YL]METHYLIDENE}-3-(PROPAN-2-YL)-2-SULFANYLIDENE-1,3-THIAZOLIDIN-4-ONE, 9-methyl-3-{(Z)-[4-oxo-3-(propan-2-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(phenylsulfanyl)-4H-pyrido[1,2-a]pyrimidin-4-one

CAS Number
608491-01-6
Molecular Formula
C22H19N3O2S3
Molecular Weight
453.06393 g/mol
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Technical Specifications

Molecular FormulaC22H19N3O2S3
Molecular Weight453.06393 g/mol
XLogP4.6
Topological Polar Surface Area (TPSA)136.0 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors6
Rotatable Bonds4
Exact Mass453.06393 Da
Heavy Atoms30
Complexity953.0
SMILESCC1=CC=CN2C1=NC(=C(C2=O)/C=C\3/C(=O)N(C(=S)S3)C(C)C)SC4=CC=CC=C4
InChIKeyABRDHBGUGNPMMN-ATVHPVEESA-N

Chemical Property Profile of 3-[(Z)-(3-ISOPROPYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)METHYL]-9-METHYL-2-(PHENYLSULFANYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE

XLogP
4.6
TPSA (Topological Polar Surface Area)
136.0
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
6
Rotatable Bonds
4
Heavy Atoms
30
Complexity
953.0
Exact Mass
453.06393
Monoisotopic Mass
453.06393
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 3-[(Z)-(3-ISOPROPYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)METHYL]-9-METHYL-2-(PHENYLSULFANYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE

The XLogP value of 4.6 indicates that 3-[(Z)-(3-ISOPROPYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)METHYL]-9-METHYL-2-(PHENYLSULFANYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 136.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(Z)-(3-ISOPROPYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)METHYL]-9-METHYL-2-(PHENYLSULFANYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE. Following Lipinski's Rule of Five, 3-[(Z)-(3-ISOPROPYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)METHYL]-9-METHYL-2-(PHENYLSULFANYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 3-[(Z)-(3-ISOPROPYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)METHYL]-9-METHYL-2-(PHENYLSULFANYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE?

The CAS number of 3-[(Z)-(3-ISOPROPYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)METHYL]-9-METHYL-2-(PHENYLSULFANYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE is 608491-01-6.

What is the molecular formula of 3-[(Z)-(3-ISOPROPYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)METHYL]-9-METHYL-2-(PHENYLSULFANYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE?

The molecular formula of 3-[(Z)-(3-ISOPROPYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)METHYL]-9-METHYL-2-(PHENYLSULFANYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE is C22H19N3O2S3.

What is the molecular weight of 3-[(Z)-(3-ISOPROPYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)METHYL]-9-METHYL-2-(PHENYLSULFANYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE?

The molecular weight of 3-[(Z)-(3-ISOPROPYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)METHYL]-9-METHYL-2-(PHENYLSULFANYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE is 453.06393 g/mol.

Where can I buy 3-[(Z)-(3-ISOPROPYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)METHYL]-9-METHYL-2-(PHENYLSULFANYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE?

You can request a quote for 3-[(Z)-(3-ISOPROPYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)METHYL]-9-METHYL-2-(PHENYLSULFANYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 3-[(Z)-(3-ISOPROPYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)METHYL]-9-METHYL-2-(PHENYLSULFANYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE?

Yes, CoreyChem provides custom synthesis services for 3-[(Z)-(3-ISOPROPYL-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-5-YLIDENE)METHYL]-9-METHYL-2-(PHENYLSULFANYL)-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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