ChemDiv1_014363
TL;DR: ChemDiv1_014363 (CAS 896699-03-9) is a chemical compound with molecular formula C23H22N4O4S and molecular weight 450.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(3,5-dimethoxyanilino)quinazolin-2-yl]sulfanyl-N-(furan-2-ylmethyl)acetamide
Also Known As: ChemDiv1_014363, 2-({4-[(3,5-dimethoxyphenyl)amino]quinazolin-2-yl}sulfanyl)-N-[(furan-2-yl)methyl]acetamide, F6548-4730, 2-[4-(3,5-dimethoxyanilino)quinazolin-2-yl]sulfanyl-N-(furan-2-ylmethyl)acetamide, 2-((4-((3,5-dimethoxyphenyl)amino)quinazolin-2-yl)thio)-N-(furan-2-ylmethyl)acetamide
| Molecular Formula | C23H22N4O4S |
|---|---|
| Molecular Weight | 450.14 g/mol |
| LogP | 4.3921 |
| Topological Polar Surface Area | 98.51 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 450.13617 |
| Heavy Atoms | 32 |
| Complexity | 1191.8334 |
Chemical Identifiers
| CAS Number | 896699-03-9 |
|---|---|
| SMILES | COC1=CC(=CC(=C1)NC2=NC(=NC3=CC=CC=C32)SCC(=O)NCC4=CC=CO4)OC |
Product Overview
ChemDiv1_014363 (CAS 896699-03-9), with molecular formula C23H22N4O4S and molecular weight 450.14 g/mol. IUPAC: 2-[4-(3,5-dimethoxyanilino)quinazolin-2-yl]sulfanyl-N-(furan-2-ylmethyl)acetamide.
Chemical Property Profile of ChemDiv1_014363
Property Insights of ChemDiv1_014363
The XLogP value of 4.3921 indicates that ChemDiv1_014363 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.51 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_014363. Following Lipinski's Rule of Five, ChemDiv1_014363 has 2 hydrogen bond donor(s) and 8 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_014363?
The CAS number of ChemDiv1_014363 is 896699-03-9.
What is the molecular formula of ChemDiv1_014363?
The molecular formula of ChemDiv1_014363 is C23H22N4O4S.
What is the molecular weight of ChemDiv1_014363?
The molecular weight of ChemDiv1_014363 is 450.14 g/mol.
Where can I buy ChemDiv1_014363?
You can request a quote for ChemDiv1_014363 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_014363?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_014363 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.