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BAS 01871781 structure
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BAS 01871781

TL;DR: BAS 01871781 (CAS 370853-70-6) is a chemical compound with molecular formula C20H18N4O4S and molecular weight 410.1049 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(5E)-5-[(4-hydroxyphenyl)methylidene]-2-[4-(2-nitrophenyl)piperazin-1-yl]-1,3-thiazol-4-one

Also Known As: BAS 01871781, AB00111348-01, (E)-5-(4-hydroxybenzylidene)-2-(4-(2-nitrophenyl)piperazin-1-yl)thiazol-4(5H)-one, F1327-0028, (5E)-5-[(4-hydroxyphenyl)methylidene]-2-[4-(2-nitrophenyl)piperazin-1-yl]-1,3-thiazol-4-one

CAS Number
370853-70-6
Molecular Formula
C20H18N4O4S
Molecular Weight
410.1049 g/mol
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Technical Specifications

Molecular FormulaC20H18N4O4S
Molecular Weight410.1049 g/mol
XLogP3.5
Topological Polar Surface Area (TPSA)127.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors6
Rotatable Bonds3
Exact Mass410.1049 Da
Heavy Atoms29
Complexity691.0
SMILESC1CN(CCN1C2=CC=CC=C2[N+](=O)[O-])C3=NC(=O)/C(=C\C4=CC=C(C=C4)O)/S3
InChIKeyNOHJOIBUFJKSAV-QGOAFFKASA-N

Chemical Property Profile of BAS 01871781

XLogP
3.5
TPSA (Topological Polar Surface Area)
127.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
6
Rotatable Bonds
3
Heavy Atoms
29
Complexity
691.0
Exact Mass
410.1049
Monoisotopic Mass
410.1049
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 BAS 01871781

The XLogP value of 3.5 indicates that BAS 01871781 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01871781. Following Lipinski's Rule of Five, BAS 01871781 has 1 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 BAS 01871781?

The CAS number of BAS 01871781 is 370853-70-6.

What is the molecular formula of BAS 01871781?

The molecular formula of BAS 01871781 is C20H18N4O4S.

What is the molecular weight of BAS 01871781?

The molecular weight of BAS 01871781 is 410.1049 g/mol.

Where can I buy BAS 01871781?

You can request a quote for BAS 01871781 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for BAS 01871781?

Yes, CoreyChem provides custom synthesis services for BAS 01871781 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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