starbld0000956
TL;DR: starbld0000956 (CAS 778619-76-4) is a chemical compound with molecular formula C22H27ClN4O2S and molecular weight 446.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(7-chloro-3-cyclohexyl-4-oxoquinazolin-2-yl)sulfanyl-N-(2-cyano-3-methylbutan-2-yl)acetamide
Also Known As: starbld0000956, 2-((7-Chloro-3-cyclohexyl-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N-(2-cyano-3-methylbutan-2-yl)acetamide, 2-(7-chloro-3-cyclohexyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(2-cyano-3-methyl-butan-2-yl)acetamide, 2-(7-chloro-3-cyclohexyl-4-oxoquinazolin-2-yl)sulfanyl-N-(2-cyano-3-methylbutan-2-yl)acetamide, 2-[(7-chloro-3-cyclohexyl-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-(1-cyano-1,2-dimethylpropyl)acetamide
| Molecular Formula | C22H27ClN4O2S |
|---|---|
| Molecular Weight | 446.15 g/mol |
| LogP | 4.70168 |
| Topological Polar Surface Area | 87.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 446.15433 |
| Heavy Atoms | 30 |
| Complexity | 1039.8348 |
Chemical Identifiers
| CAS Number | 778619-76-4 |
|---|---|
| SMILES | CC(C)C(C)(C#N)NC(=O)CSC1=NC2=C(C=CC(=C2)Cl)C(=O)N1C3CCCCC3 |
Product Overview
starbld0000956 (CAS 778619-76-4), with molecular formula C22H27ClN4O2S and molecular weight 446.15 g/mol. IUPAC: 2-(7-chloro-3-cyclohexyl-4-oxoquinazolin-2-yl)sulfanyl-N-(2-cyano-3-methylbutan-2-yl)acetamide.
Chemical Property Profile of starbld0000956
Property Insights of starbld0000956
The XLogP value of 4.70168 indicates that starbld0000956 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 starbld0000956. Following Lipinski's Rule of Five, starbld0000956 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 starbld0000956?
The CAS number of starbld0000956 is 778619-76-4.
What is the molecular formula of starbld0000956?
The molecular formula of starbld0000956 is C22H27ClN4O2S.
What is the molecular weight of starbld0000956?
The molecular weight of starbld0000956 is 446.15 g/mol.
Where can I buy starbld0000956?
You can request a quote for starbld0000956 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for starbld0000956?
Yes, KEHONG BIO provides custom synthesis services for starbld0000956 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.