ChemDiv1_008653
TL;DR: ChemDiv1_008653 (CAS 434313-00-5) is a chemical compound with molecular formula C21H20N6O3 and molecular weight 404.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(6-methoxy-4-methylquinazolin-2-yl)amino]-6-oxo-N-phenyl-4,5-dihydro-1H-pyrimidine-4-carboxamide
Also Known As: ChemDiv1_008653, BAS 02998704, AO-567/40646848, 2-[(6-methoxy-4-methylquinazolin-2-yl)amino]-6-oxo-N-phenyl-1,4,5,6-tetrahydropyrimidine-4-carboxamide, 2-[(6-methoxy-4-methylquinazolin-2-yl)amino]-6-oxo-N-phenyl-4,5-dihydro-1H-pyrimidine-4-carboxamide
| Molecular Formula | C21H20N6O3 |
|---|---|
| Molecular Weight | 404.16 g/mol |
| LogP | 2.24192 |
| Topological Polar Surface Area | 117.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 404.1597 |
| Heavy Atoms | 30 |
| Complexity | 1146.1918 |
Chemical Identifiers
| CAS Number | 434313-00-5 |
|---|---|
| SMILES | CC1=C2C=C(C=CC2=NC(=N1)NC3=NC(CC(=O)N3)C(=O)NC4=CC=CC=C4)OC |
Product Overview
ChemDiv1_008653 (CAS 434313-00-5), with molecular formula C21H20N6O3 and molecular weight 404.16 g/mol. IUPAC: 2-[(6-methoxy-4-methylquinazolin-2-yl)amino]-6-oxo-N-phenyl-4,5-dihydro-1H-pyrimidine-4-carboxamide.
Chemical Property Profile of ChemDiv1_008653
Property Insights of ChemDiv1_008653
The XLogP value of 2.24192 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_008653. The TPSA of 117.6 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_008653. Following Lipinski's Rule of Five, ChemDiv1_008653 has 3 hydrogen bond donor(s) and 7 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_008653?
The CAS number of ChemDiv1_008653 is 434313-00-5.
What is the molecular formula of ChemDiv1_008653?
The molecular formula of ChemDiv1_008653 is C21H20N6O3.
What is the molecular weight of ChemDiv1_008653?
The molecular weight of ChemDiv1_008653 is 404.16 g/mol.
Where can I buy ChemDiv1_008653?
You can request a quote for ChemDiv1_008653 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_008653?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_008653 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.