ChemDiv3_012654
TL;DR: ChemDiv3_012654 (CAS 403722-92-9) is a chemical compound with molecular formula C23H21N3O3S and molecular weight 419.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(furan-2-ylmethyl)-2-[4-oxo-3-(2-phenylethyl)quinazolin-2-yl]sulfanylacetamide
Also Known As: ChemDiv3_012654, BAS 04050421, AO-080/41038880, BRD-K92111378-001-01-1, N-(2-furylmethyl)-2-{[4-oxo-3-(2-phenylethyl)-3,4-dihydroquinazolin-2-yl]thio}acetamide
| Molecular Formula | C23H21N3O3S |
|---|---|
| Molecular Weight | 419.13 g/mol |
| LogP | 3.6407 |
| Topological Polar Surface Area | 77.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 419.13037 |
| Heavy Atoms | 30 |
| Complexity | 1187.5304 |
Chemical Identifiers
| CAS Number | 403722-92-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCN2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCC4=CC=CO4 |
Product Overview
ChemDiv3_012654 (CAS 403722-92-9), with molecular formula C23H21N3O3S and molecular weight 419.13 g/mol. IUPAC: N-(furan-2-ylmethyl)-2-[4-oxo-3-(2-phenylethyl)quinazolin-2-yl]sulfanylacetamide.
Chemical Property Profile of ChemDiv3_012654
Property Insights of ChemDiv3_012654
The XLogP value of 3.6407 indicates that ChemDiv3_012654 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.13 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_012654. Following Lipinski's Rule of Five, ChemDiv3_012654 has 1 hydrogen bond donor(s) and 5 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_012654?
The CAS number of ChemDiv3_012654 is 403722-92-9.
What is the molecular formula of ChemDiv3_012654?
The molecular formula of ChemDiv3_012654 is C23H21N3O3S.
What is the molecular weight of ChemDiv3_012654?
The molecular weight of ChemDiv3_012654 is 419.13 g/mol.
Where can I buy ChemDiv3_012654?
You can request a quote for ChemDiv3_012654 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_012654?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_012654 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.