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2-imino-N-(4-methylbenzyl)-5-oxo-1-(2-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide structure
Fine Chemical

2-imino-N-(4-methylbenzyl)-5-oxo-1-(2-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide

TL;DR: 2-imino-N-(4-methylbenzyl)-5-oxo-1-(2-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide (CAS 636989-25-8) is a chemical compound with molecular formula C28H25N5O2 and molecular weight 463.20084 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

6-imino-N-[(4-methylphenyl)methyl]-2-oxo-7-(2-phenylethyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide

Also Known As: 2-imino-N-(4-methylbenzyl)-5-oxo-1-(2-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide, 2-imino-N-(4-methylbenzyl)-5-oxo-1-phenethyl-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide

CAS Number
636989-25-8
Molecular Formula
C28H25N5O2
Molecular Weight
463.20084 g/mol
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Technical Specifications

Molecular FormulaC28H25N5O2
Molecular Weight463.20084 g/mol
XLogP3.3
Topological Polar Surface Area (TPSA)88.9 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors4
Rotatable Bonds6
Exact Mass463.20084 Da
Heavy Atoms35
Complexity1040.0
SMILESCC1=CC=C(C=C1)CNC(=O)C2=CC3=C(N=C4C=CC=CN4C3=O)N(C2=N)CCC5=CC=CC=C5
InChIKeyNKTSOHJDHISPLD-UHFFFAOYSA-N

Chemical Property Profile of 2-imino-N-(4-methylbenzyl)-5-oxo-1-(2-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide

XLogP
3.3
TPSA (Topological Polar Surface Area)
88.9
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
4
Rotatable Bonds
6
Heavy Atoms
35
Complexity
1040.0
Exact Mass
463.20084
Monoisotopic Mass
463.20084
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 2-imino-N-(4-methylbenzyl)-5-oxo-1-(2-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide

The XLogP value of 3.3 indicates that 2-imino-N-(4-methylbenzyl)-5-oxo-1-(2-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-imino-N-(4-methylbenzyl)-5-oxo-1-(2-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide. Following Lipinski's Rule of Five, 2-imino-N-(4-methylbenzyl)-5-oxo-1-(2-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 2-imino-N-(4-methylbenzyl)-5-oxo-1-(2-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide?

The CAS number of 2-imino-N-(4-methylbenzyl)-5-oxo-1-(2-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide is 636989-25-8.

What is the molecular formula of 2-imino-N-(4-methylbenzyl)-5-oxo-1-(2-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide?

The molecular formula of 2-imino-N-(4-methylbenzyl)-5-oxo-1-(2-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide is C28H25N5O2.

What is the molecular weight of 2-imino-N-(4-methylbenzyl)-5-oxo-1-(2-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide?

The molecular weight of 2-imino-N-(4-methylbenzyl)-5-oxo-1-(2-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide is 463.20084 g/mol.

Where can I buy 2-imino-N-(4-methylbenzyl)-5-oxo-1-(2-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide?

You can request a quote for 2-imino-N-(4-methylbenzyl)-5-oxo-1-(2-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-imino-N-(4-methylbenzyl)-5-oxo-1-(2-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide?

Yes, CoreyChem provides custom synthesis services for 2-imino-N-(4-methylbenzyl)-5-oxo-1-(2-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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