ChemDiv2_003788
TL;DR: ChemDiv2_003788 (CAS 349132-67-8) is a chemical compound with molecular formula C16H13ClN6O3 and molecular weight 372.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloro-4-cyanophenyl)-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide
Also Known As: ChemDiv2_003788, IDI1_002503, BAS 02064369, N-(3-chloro-4-cyanophenyl)-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide, N-(3-chloro-4-cyanophenyl)-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide
| Molecular Formula | C16H13ClN6O3 |
|---|---|
| Molecular Weight | 372.07 g/mol |
| LogP | 0.59748 |
| Topological Polar Surface Area | 114.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 372.07376 |
| Heavy Atoms | 26 |
| Complexity | 1197.6313 |
Chemical Identifiers
| CAS Number | 349132-67-8 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NC3=CC(=C(C=C3)C#N)Cl |
Product Overview
ChemDiv2_003788 (CAS 349132-67-8), with molecular formula C16H13ClN6O3 and molecular weight 372.07 g/mol. IUPAC: N-(3-chloro-4-cyanophenyl)-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide.
Chemical Property Profile of ChemDiv2_003788
Property Insights of ChemDiv2_003788
The XLogP value of 0.59748 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv2_003788. The TPSA of 114.71 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv2_003788. Following Lipinski's Rule of Five, ChemDiv2_003788 has 1 hydrogen bond donor(s) and 5 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 ChemDiv2_003788?
The CAS number of ChemDiv2_003788 is 349132-67-8.
What is the molecular formula of ChemDiv2_003788?
The molecular formula of ChemDiv2_003788 is C16H13ClN6O3.
What is the molecular weight of ChemDiv2_003788?
The molecular weight of ChemDiv2_003788 is 372.07 g/mol.
Where can I buy ChemDiv2_003788?
You can request a quote for ChemDiv2_003788 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_003788?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_003788 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.