ChemDiv3_006929
TL;DR: ChemDiv3_006929 (CAS 669752-60-7) is a chemical compound with molecular formula C23H22N4O2 and molecular weight 386.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzoxazol-2-ylamino)-7,7-dimethyl-4-phenyl-1,4,6,8-tetrahydroquinazolin-5-one
Also Known As: ChemDiv3_006929, IDI1_024839, 2-(1,3-benzoxazol-2-ylamino)-7,7-dimethyl-4-phenyl-4,6,7,8-tetrahydroquinazolin-5(1H)-one, BRD-A91018161-001-01-2, 2-(1,3-benzoxazol-2-ylamino)-7,7-dimethyl-4-phenyl-1,4,6,8-tetrahydroquinazolin-5-one
| Molecular Formula | C23H22N4O2 |
|---|---|
| Molecular Weight | 386.17 g/mol |
| LogP | 4.5834 |
| Topological Polar Surface Area | 79.52 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 386.1743 |
| Heavy Atoms | 29 |
| Complexity | 1124.8492 |
Chemical Identifiers
| CAS Number | 669752-60-7 |
|---|---|
| SMILES | CC1(CC2=C(C(N=C(N2)NC3=NC4=CC=CC=C4O3)C5=CC=CC=C5)C(=O)C1)C |
Product Overview
ChemDiv3_006929 (CAS 669752-60-7), with molecular formula C23H22N4O2 and molecular weight 386.17 g/mol. IUPAC: 2-(1,3-benzoxazol-2-ylamino)-7,7-dimethyl-4-phenyl-1,4,6,8-tetrahydroquinazolin-5-one.
Chemical Property Profile of ChemDiv3_006929
Property Insights of ChemDiv3_006929
The XLogP value of 4.5834 indicates that ChemDiv3_006929 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.52 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_006929. Following Lipinski's Rule of Five, ChemDiv3_006929 has 2 hydrogen bond donor(s) and 6 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 ChemDiv3_006929?
The CAS number of ChemDiv3_006929 is 669752-60-7.
What is the molecular formula of ChemDiv3_006929?
The molecular formula of ChemDiv3_006929 is C23H22N4O2.
What is the molecular weight of ChemDiv3_006929?
The molecular weight of ChemDiv3_006929 is 386.17 g/mol.
Where can I buy ChemDiv3_006929?
You can request a quote for ChemDiv3_006929 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_006929?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_006929 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.