starbld0004845
TL;DR: starbld0004845 (CAS 793719-68-3) is a chemical compound with molecular formula C24H22ClFN4O2S and molecular weight 484.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(3-chloro-4-fluorophenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(1-cyanocyclohexyl)propanamide
Also Known As: starbld0004845, 2-{[3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N-(1-cyanocyclohexyl)propanamide, 2-((3-(3-Chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N-(1-cyanocyclohexyl)propanamide, 2-[3-(3-chloro-4-fluoro-phenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(1-cyanocyclohexyl)propanamide, 2-[3-(3-chloro-4-fluorophenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(1-cyanocyclohexyl)propanamide
| Molecular Formula | C24H22ClFN4O2S |
|---|---|
| Molecular Weight | 484.11 g/mol |
| LogP | 5.00148 |
| Topological Polar Surface Area | 87.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 484.11362 |
| Heavy Atoms | 33 |
| Complexity | 1314.0426 |
Chemical Identifiers
| CAS Number | 793719-68-3 |
|---|---|
| SMILES | CC(C(=O)NC1(CCCCC1)C#N)SC2=NC3=CC=CC=C3C(=O)N2C4=CC(=C(C=C4)F)Cl |
Product Overview
starbld0004845 (CAS 793719-68-3), with molecular formula C24H22ClFN4O2S and molecular weight 484.11 g/mol. IUPAC: 2-[3-(3-chloro-4-fluorophenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(1-cyanocyclohexyl)propanamide.
Chemical Property Profile of starbld0004845
Property Insights of starbld0004845
The XLogP value of 5.00148 indicates that starbld0004845 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.78 Ų falls within the moderate polarity range, balancing permeability and solubility for starbld0004845. Following Lipinski's Rule of Five, starbld0004845 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of starbld0004845?
The CAS number of starbld0004845 is 793719-68-3.
What is the molecular formula of starbld0004845?
The molecular formula of starbld0004845 is C24H22ClFN4O2S.
What is the molecular weight of starbld0004845?
The molecular weight of starbld0004845 is 484.11 g/mol.
Where can I buy starbld0004845?
You can request a quote for starbld0004845 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for starbld0004845?
Yes, KEHONG BIO provides custom synthesis services for starbld0004845 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.