ChemDiv1_005936
TL;DR: ChemDiv1_005936 (CAS 332117-10-9) is a chemical compound with molecular formula C17H19N5O3 and molecular weight 341.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(2,3-dimethylphenyl)acetamide
Also Known As: ChemDiv1_005936, BAS 01129913, AB01295096-01, 2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(2,3-dimethylphenyl)acetamide, 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(2,3-dimethylphenyl)acetamide
| Molecular Formula | C17H19N5O3 |
|---|---|
| Molecular Weight | 341.15 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 87.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 341.1488 |
| Heavy Atoms | 25 |
| Complexity | 568.0 |
Chemical Identifiers
| CAS Number | 332117-10-9 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)NC(=O)CN2C=NC3=C2C(=O)N(C(=O)N3C)C)C |
| InChIKey | IDGMJUXKGPSUDC-UHFFFAOYSA-N |
Product Overview
ChemDiv1_005936 (CAS 332117-10-9), with molecular formula C17H19N5O3 and molecular weight 341.15 g/mol. IUPAC: 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(2,3-dimethylphenyl)acetamide.
Chemical Property Profile of ChemDiv1_005936
Property Insights of ChemDiv1_005936
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_005936. The TPSA of 87.5 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_005936. Following Lipinski's Rule of Five, ChemDiv1_005936 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 ChemDiv1_005936?
The CAS number of ChemDiv1_005936 is 332117-10-9.
What is the molecular formula of ChemDiv1_005936?
The molecular formula of ChemDiv1_005936 is C17H19N5O3.
What is the molecular weight of ChemDiv1_005936?
The molecular weight of ChemDiv1_005936 is 341.15 g/mol.
Where can I buy ChemDiv1_005936?
You can request a quote for ChemDiv1_005936 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_005936?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_005936 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.