(+)-KW-7158
TL;DR: (+)-KW-7158 (CAS 214764-26-8) is a chemical compound with molecular formula C16H12F3NO5S2 and molecular weight 419.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-3,3,3-trifluoro-2-hydroxy-2-methyl-N-(5,5,10-trioxo-4H-thieno[3,2-c][1]benzothiepin-9-yl)propanamide
Also Known As: (+)-KW-7158, (S)-5,5-Dioxo-9-((3,3,3-trifluoro-2-hydroxy-2-methylpropanoyl)amino)-4,10-dihydrothieno(3,2-C)(1)benzothiepin-10-one, (2S)-3,3,3-trifluoro-2-hydroxy-2-methyl-N-(5,5,10-trioxo-4H-thieno[3,2-c][1]benzothiepin-9-yl)propanamide, (S)-N-(5,5-dioxido-10-oxo-4,10-dihydrobenzo[b]thieno[2,3-e]thiepin-9-yl)-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide, N-(5,5-dioxo-10-oxo-4,10-dihydrothieno(3,2-c)(1)benzothiepin-9-yl)-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide
| Molecular Formula | C16H12F3NO5S2 |
|---|---|
| Molecular Weight | 419.01 g/mol |
| LogP | 2.5182 |
| Topological Polar Surface Area | 100.54 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 419.0109 |
| Heavy Atoms | 27 |
| Complexity | 1054.2483 |
Chemical Identifiers
| CAS Number | 214764-26-8 |
|---|---|
| SMILES | C[C@](C(=O)NC1=C2C(=CC=C1)S(=O)(=O)CC3=C(C2=O)SC=C3)(C(F)(F)F)O |
Product Overview
(+)-KW-7158 (CAS 214764-26-8), with molecular formula C16H12F3NO5S2 and molecular weight 419.01 g/mol. IUPAC: (2S)-3,3,3-trifluoro-2-hydroxy-2-methyl-N-(5,5,10-trioxo-4H-thieno[3,2-c][1]benzothiepin-9-yl)propanamide.
Chemical Property Profile of (+)-KW-7158
Property Insights of (+)-KW-7158
The XLogP value of 2.5182 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (+)-KW-7158. The TPSA of 100.54 Ų falls within the moderate polarity range, balancing permeability and solubility for (+)-KW-7158. Following Lipinski's Rule of Five, (+)-KW-7158 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 (+)-KW-7158?
The CAS number of (+)-KW-7158 is 214764-26-8.
What is the molecular formula of (+)-KW-7158?
The molecular formula of (+)-KW-7158 is C16H12F3NO5S2.
What is the molecular weight of (+)-KW-7158?
The molecular weight of (+)-KW-7158 is 419.01 g/mol.
Where can I buy (+)-KW-7158?
You can request a quote for (+)-KW-7158 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (+)-KW-7158?
Yes, KEHONG BIO provides custom synthesis services for (+)-KW-7158 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.