BAS 01128337
TL;DR: BAS 01128337 (CAS 1164527-71-2) is a chemical compound with molecular formula C24H21FN2O2S and molecular weight 420.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-3-(3-fluoroanilino)-1-(4-methylsulfanylphenyl)-3-oxoprop-1-en-2-yl]-4-methylbenzamide
Also Known As: BAS 01128337, N-[1-(3-Fluoro-phenylcarbamoyl)-2-(4-methylsulfanyl-phenyl)-vinyl]-4-methyl-benzamide, N-[(E)-3-(3-fluoroanilino)-1-(4-methylsulfanylphenyl)-3-oxoprop-1-en-2-yl]-4-methylbenzamide, N-[(E)-1-[(3-fluorophenyl)carbamoyl]-2-[4-(methylthio)phenyl]vinyl]-4-methyl-benzamide, (2E)-N-(3-fluorophenyl)-2-[(4-methylphenyl)carbonylamino]-3-(4-methylthiopheny l)prop-2-enamide
| Molecular Formula | C24H21FN2O2S |
|---|---|
| Molecular Weight | 420.13 g/mol |
| LogP | 5.26562 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 420.13077 |
| Heavy Atoms | 30 |
| Complexity | 1077.1199 |
Chemical Identifiers
| CAS Number | 1164527-71-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)N/C(=C/C2=CC=C(C=C2)SC)/C(=O)NC3=CC(=CC=C3)F |
Product Overview
BAS 01128337 (CAS 1164527-71-2), with molecular formula C24H21FN2O2S and molecular weight 420.13 g/mol. IUPAC: N-[(E)-3-(3-fluoroanilino)-1-(4-methylsulfanylphenyl)-3-oxoprop-1-en-2-yl]-4-methylbenzamide.
Chemical Property Profile of BAS 01128337
Property Insights of BAS 01128337
The XLogP value of 5.26562 indicates that BAS 01128337 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 01128337 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01128337 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 01128337?
The CAS number of BAS 01128337 is 1164527-71-2.
What is the molecular formula of BAS 01128337?
The molecular formula of BAS 01128337 is C24H21FN2O2S.
What is the molecular weight of BAS 01128337?
The molecular weight of BAS 01128337 is 420.13 g/mol.
Where can I buy BAS 01128337?
You can request a quote for BAS 01128337 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01128337?
Yes, KEHONG BIO provides custom synthesis services for BAS 01128337 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.