![N-[(2-chlorophenyl)methyl]-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide structure](/static/products/7019/701946-61-4.webp)
N-[(2-chlorophenyl)methyl]-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide
TL;DR: N-[(2-chlorophenyl)methyl]-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide (CAS 701946-61-4) is a chemical compound with molecular formula C16H16ClN5O3 and molecular weight 361.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-chlorophenyl)methyl]-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide
Also Known As: CBKinase1_007031, CBKinase1_019431, BAS 07856705, BRD-K77025901-001-01-8, N-[(2-chlorophenyl)methyl]-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide
| Molecular Formula | C16H16ClN5O3 |
|---|---|
| Molecular Weight | 361.09 g/mol |
| LogP | 0.4035 |
| Topological Polar Surface Area | 90.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 361.09418 |
| Heavy Atoms | 25 |
| Complexity | 1079.5442 |
Chemical Identifiers
| CAS Number | 701946-61-4 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NCC3=CC=CC=C3Cl |
Product Overview
N-[(2-chlorophenyl)methyl]-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide (CAS 701946-61-4), with molecular formula C16H16ClN5O3 and molecular weight 361.09 g/mol. IUPAC: N-[(2-chlorophenyl)methyl]-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide.
Chemical Property Profile of N-[(2-chlorophenyl)methyl]-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide
Property Insights of N-[(2-chlorophenyl)methyl]-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide
The XLogP value of 0.4035 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(2-chlorophenyl)methyl]-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide. The TPSA of 90.92 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(2-chlorophenyl)methyl]-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide. Following Lipinski's Rule of Five, N-[(2-chlorophenyl)methyl]-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide 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-[(2-chlorophenyl)methyl]-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide?
The CAS number of N-[(2-chlorophenyl)methyl]-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide is 701946-61-4.
What is the molecular formula of N-[(2-chlorophenyl)methyl]-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide?
The molecular formula of N-[(2-chlorophenyl)methyl]-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide is C16H16ClN5O3.
What is the molecular weight of N-[(2-chlorophenyl)methyl]-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide?
The molecular weight of N-[(2-chlorophenyl)methyl]-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide is 361.09 g/mol.
Where can I buy N-[(2-chlorophenyl)methyl]-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide?
You can request a quote for N-[(2-chlorophenyl)methyl]-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(2-chlorophenyl)methyl]-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(2-chlorophenyl)methyl]-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.