N-(9-Benzyl-9H-purin-6-yl)benzenecarboximidic acid
TL;DR: N-(9-Benzyl-9H-purin-6-yl)benzenecarboximidic acid (CAS 33360-19-9) is a chemical compound with molecular formula C19H15N5O and molecular weight 329.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(9-benzylpurin-6-yl)benzamide
Also Known As: N-(9-benzylpurin-6-yl)benzamide, n-(9-benzyl-9h-purin-6-yl)benzamide, N-(9-Benzyl-9H-purin-6-yl)benzenecarboximidic acid, BENZAMIDE,N-[9-(PHENYLMETHYL)-9H-PURIN-6-YL]-
| Molecular Formula | C19H15N5O |
|---|---|
| Molecular Weight | 329.13 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 329.12766 |
| Heavy Atoms | 25 |
| Complexity | 447.0 |
Chemical Identifiers
| CAS Number | 33360-19-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C=NC3=C(N=CN=C32)NC(=O)C4=CC=CC=C4 |
| InChIKey | DIVBNLJUYMFQHZ-UHFFFAOYSA-N |
Product Overview
N-(9-Benzyl-9H-purin-6-yl)benzenecarboximidic acid (CAS 33360-19-9), with molecular formula C19H15N5O and molecular weight 329.13 g/mol. IUPAC: N-(9-benzylpurin-6-yl)benzamide.
Chemical Property Profile of N-(9-Benzyl-9H-purin-6-yl)benzenecarboximidic acid
Property Insights of N-(9-Benzyl-9H-purin-6-yl)benzenecarboximidic acid
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(9-Benzyl-9H-purin-6-yl)benzenecarboximidic acid. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(9-Benzyl-9H-purin-6-yl)benzenecarboximidic acid. Following Lipinski's Rule of Five, N-(9-Benzyl-9H-purin-6-yl)benzenecarboximidic acid has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(9-Benzyl-9H-purin-6-yl)benzenecarboximidic acid?
The CAS number of N-(9-Benzyl-9H-purin-6-yl)benzenecarboximidic acid is 33360-19-9.
What is the molecular formula of N-(9-Benzyl-9H-purin-6-yl)benzenecarboximidic acid?
The molecular formula of N-(9-Benzyl-9H-purin-6-yl)benzenecarboximidic acid is C19H15N5O.
What is the molecular weight of N-(9-Benzyl-9H-purin-6-yl)benzenecarboximidic acid?
The molecular weight of N-(9-Benzyl-9H-purin-6-yl)benzenecarboximidic acid is 329.13 g/mol.
Where can I buy N-(9-Benzyl-9H-purin-6-yl)benzenecarboximidic acid?
You can request a quote for N-(9-Benzyl-9H-purin-6-yl)benzenecarboximidic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(9-Benzyl-9H-purin-6-yl)benzenecarboximidic acid?
Yes, KEHONG BIO provides custom synthesis services for N-(9-Benzyl-9H-purin-6-yl)benzenecarboximidic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.