BAS 01128338
TL;DR: BAS 01128338 (CAS 332115-17-0) is a chemical compound with molecular formula C25H21F3N2O2S and molecular weight 470.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-N-[(E)-1-(4-methylsulfanylphenyl)-3-oxo-3-[3-(trifluoromethyl)anilino]prop-1-en-2-yl]benzamide
Also Known As: BAS 01128338, (E)-4-methyl-N-(1-(4-(methylthio)phenyl)-3-oxo-3-((3-(trifluoromethyl)phenyl)amino)prop-1-en-2-yl)benzamide, 4-methyl-N-[(1E)-1-[4-(methylsulfanyl)phenyl]-3-oxo-3-{[3-(trifluoromethyl)phenyl]amino}prop-1-en-2-yl]benzamide, 4-methyl-N-[(E)-1-(4-methylsulfanylphenyl)-3-oxo-3-[3-(trifluoromethyl)anilino]prop-1-en-2-yl]benzamide
| Molecular Formula | C25H21F3N2O2S |
|---|---|
| Molecular Weight | 470.13 g/mol |
| LogP | 6.14532 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 470.1276 |
| Heavy Atoms | 33 |
| Complexity | 1171.5065 |
Chemical Identifiers
| CAS Number | 332115-17-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)N/C(=C/C2=CC=C(C=C2)SC)/C(=O)NC3=CC=CC(=C3)C(F)(F)F |
Product Overview
BAS 01128338 (CAS 332115-17-0), with molecular formula C25H21F3N2O2S and molecular weight 470.13 g/mol. IUPAC: 4-methyl-N-[(E)-1-(4-methylsulfanylphenyl)-3-oxo-3-[3-(trifluoromethyl)anilino]prop-1-en-2-yl]benzamide.
Chemical Property Profile of BAS 01128338
Property Insights of BAS 01128338
The XLogP value of 6.14532 indicates that BAS 01128338 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.2 Ų, BAS 01128338 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01128338 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01128338?
The CAS number of BAS 01128338 is 332115-17-0.
What is the molecular formula of BAS 01128338?
The molecular formula of BAS 01128338 is C25H21F3N2O2S.
What is the molecular weight of BAS 01128338?
The molecular weight of BAS 01128338 is 470.13 g/mol.
Where can I buy BAS 01128338?
You can request a quote for BAS 01128338 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01128338?
Yes, KEHONG BIO provides custom synthesis services for BAS 01128338 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.