starbld0003995
TL;DR: starbld0003995 (CAS 522641-19-6) is a chemical compound with molecular formula C17H15F3N2O3S and molecular weight 384.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-oxo-1-[3-(trifluoromethyl)anilino]propan-2-yl] 2-methylsulfanylpyridine-3-carboxylate
Also Known As: starbld0003995, AB00714178-01, 1-Oxo-1-((3-(trifluoromethyl)phenyl)amino)propan-2-yl 2-(methylthio)nicotinate, [1-oxo-1-[3-(trifluoromethyl)anilino]propan-2-yl] 2-methylsulfanylpyridine-3-carboxylate, 1-{[3-(trifluoromethyl)phenyl]carbamoyl}ethyl 2-(methylsulfanyl)pyridine-3-carboxylate
| Molecular Formula | C17H15F3N2O3S |
|---|---|
| Molecular Weight | 384.08 g/mol |
| LogP | 4.0063 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 384.07556 |
| Heavy Atoms | 26 |
| Complexity | 811.83527 |
Chemical Identifiers
| CAS Number | 522641-19-6 |
|---|---|
| SMILES | CC(C(=O)NC1=CC=CC(=C1)C(F)(F)F)OC(=O)C2=C(N=CC=C2)SC |
Product Overview
starbld0003995 (CAS 522641-19-6), with molecular formula C17H15F3N2O3S and molecular weight 384.08 g/mol. IUPAC: [1-oxo-1-[3-(trifluoromethyl)anilino]propan-2-yl] 2-methylsulfanylpyridine-3-carboxylate.
Chemical Property Profile of starbld0003995
Property Insights of starbld0003995
The XLogP value of 4.0063 indicates that starbld0003995 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for starbld0003995. Following Lipinski's Rule of Five, starbld0003995 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 starbld0003995?
The CAS number of starbld0003995 is 522641-19-6.
What is the molecular formula of starbld0003995?
The molecular formula of starbld0003995 is C17H15F3N2O3S.
What is the molecular weight of starbld0003995?
The molecular weight of starbld0003995 is 384.08 g/mol.
Where can I buy starbld0003995?
You can request a quote for starbld0003995 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for starbld0003995?
Yes, KEHONG BIO provides custom synthesis services for starbld0003995 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.