AB00679707-01
TL;DR: AB00679707-01 (CAS 898446-84-9) is a chemical compound with molecular formula C20H16ClN5O2 and molecular weight 393.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-chlorophenyl)-9-(3,4-dimethylphenyl)-8-oxo-7H-purine-6-carboxamide
Also Known As: AB00679707-01, 2-(2-chlorophenyl)-9-(3,4-dimethylphenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide, F2565-0174, 2-(2-chlorophenyl)-9-(3,4-dimethylphenyl)-8-oxo-7H-purine-6-carboxamide
| Molecular Formula | C20H16ClN5O2 |
|---|---|
| Molecular Weight | 393.10 g/mol |
| LogP | 3.14494 |
| Topological Polar Surface Area | 106.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 393.09924 |
| Heavy Atoms | 28 |
| Complexity | 1305.9379 |
Chemical Identifiers
| CAS Number | 898446-84-9 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=CC=CC=C4Cl)C |
Product Overview
AB00679707-01 (CAS 898446-84-9), with molecular formula C20H16ClN5O2 and molecular weight 393.10 g/mol. IUPAC: 2-(2-chlorophenyl)-9-(3,4-dimethylphenyl)-8-oxo-7H-purine-6-carboxamide.
Chemical Property Profile of AB00679707-01
Property Insights of AB00679707-01
The XLogP value of 3.14494 indicates that AB00679707-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.66 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00679707-01. Following Lipinski's Rule of Five, AB00679707-01 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
Frequently Asked Questions
What is the CAS number of AB00679707-01?
The CAS number of AB00679707-01 is 898446-84-9.
What is the molecular formula of AB00679707-01?
The molecular formula of AB00679707-01 is C20H16ClN5O2.
What is the molecular weight of AB00679707-01?
The molecular weight of AB00679707-01 is 393.10 g/mol.
Where can I buy AB00679707-01?
You can request a quote for AB00679707-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00679707-01?
Yes, KEHONG BIO provides custom synthesis services for AB00679707-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.