9-(3,4-dimethylphenyl)-2-(3-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
TL;DR: 9-(3,4-dimethylphenyl)-2-(3-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide (CAS 898442-65-4) is a chemical compound with molecular formula C20H16FN5O2 and molecular weight 377.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-(3,4-dimethylphenyl)-2-(3-fluorophenyl)-8-oxo-7H-purine-6-carboxamide
Also Known As: 9-(3,4-dimethylphenyl)-2-(3-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide, AB00679712-01, 9-(3,4-dimethylphenyl)-2-(3-fluorophenyl)-8-oxo-7H-purine-6-carboxamide, F2565-0180
| Molecular Formula | C20H16FN5O2 |
|---|---|
| Molecular Weight | 377.13 g/mol |
| LogP | 2.63064 |
| Topological Polar Surface Area | 106.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 377.1288 |
| Heavy Atoms | 28 |
| Complexity | 1305.9379 |
Chemical Identifiers
| CAS Number | 898442-65-4 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N2C3=NC(=NC(=C3NC2=O)C(=O)N)C4=CC(=CC=C4)F)C |
Product Overview
9-(3,4-dimethylphenyl)-2-(3-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide (CAS 898442-65-4), with molecular formula C20H16FN5O2 and molecular weight 377.13 g/mol. IUPAC: 9-(3,4-dimethylphenyl)-2-(3-fluorophenyl)-8-oxo-7H-purine-6-carboxamide.
Chemical Property Profile of 9-(3,4-dimethylphenyl)-2-(3-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
Property Insights of 9-(3,4-dimethylphenyl)-2-(3-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
The XLogP value of 2.63064 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9-(3,4-dimethylphenyl)-2-(3-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide. The TPSA of 106.66 Ų falls within the moderate polarity range, balancing permeability and solubility for 9-(3,4-dimethylphenyl)-2-(3-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide. Following Lipinski's Rule of Five, 9-(3,4-dimethylphenyl)-2-(3-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide 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 9-(3,4-dimethylphenyl)-2-(3-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide?
The CAS number of 9-(3,4-dimethylphenyl)-2-(3-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide is 898442-65-4.
What is the molecular formula of 9-(3,4-dimethylphenyl)-2-(3-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide?
The molecular formula of 9-(3,4-dimethylphenyl)-2-(3-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide is C20H16FN5O2.
What is the molecular weight of 9-(3,4-dimethylphenyl)-2-(3-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide?
The molecular weight of 9-(3,4-dimethylphenyl)-2-(3-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide is 377.13 g/mol.
Where can I buy 9-(3,4-dimethylphenyl)-2-(3-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide?
You can request a quote for 9-(3,4-dimethylphenyl)-2-(3-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-(3,4-dimethylphenyl)-2-(3-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 9-(3,4-dimethylphenyl)-2-(3-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.