BAS 01055581
TL;DR: BAS 01055581 (CAS 304895-95-2) is a chemical compound with molecular formula C20H14ClF3N2OS and molecular weight 422.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-[5-[(4-chlorophenyl)methyl]-1,3-thiazol-2-yl]-3-[3-(trifluoromethyl)phenyl]prop-2-enamide
Also Known As: BAS 01055581, (2E)-N-[5-(4-chlorobenzyl)-1,3-thiazol-2-yl]-3-[3-(trifluoromethyl)phenyl]prop-2-enamide, (E)-N-(5-(4-chlorobenzyl)thiazol-2-yl)-3-(3-(trifluoromethyl)phenyl)acrylamide, N-(5-(4-CHLOROBENZYL)-1,3-THIAZOL-2-YL)-3-(3-(TRIFLUOROMETHYL)PHENYL)ACRYLAMIDE, N-[5-(4-Chloro-benzyl)-thiazol-2-yl]-3-(3-trifluoromethyl-phenyl)-acrylamide
| Molecular Formula | C20H14ClF3N2OS |
|---|---|
| Molecular Weight | 422.05 g/mol |
| LogP | 6.058 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 422.04675 |
| Heavy Atoms | 28 |
| Complexity | 997.1854 |
Chemical Identifiers
| CAS Number | 304895-95-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(F)(F)F)/C=C/C(=O)NC2=NC=C(S2)CC3=CC=C(C=C3)Cl |
Product Overview
BAS 01055581 (CAS 304895-95-2), with molecular formula C20H14ClF3N2OS and molecular weight 422.05 g/mol. IUPAC: (E)-N-[5-[(4-chlorophenyl)methyl]-1,3-thiazol-2-yl]-3-[3-(trifluoromethyl)phenyl]prop-2-enamide.
Chemical Property Profile of BAS 01055581
Property Insights of BAS 01055581
The XLogP value of 6.058 indicates that BAS 01055581 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.99 Ų, BAS 01055581 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01055581 has 1 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 01055581?
The CAS number of BAS 01055581 is 304895-95-2.
What is the molecular formula of BAS 01055581?
The molecular formula of BAS 01055581 is C20H14ClF3N2OS.
What is the molecular weight of BAS 01055581?
The molecular weight of BAS 01055581 is 422.05 g/mol.
Where can I buy BAS 01055581?
You can request a quote for BAS 01055581 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01055581?
Yes, KEHONG BIO provides custom synthesis services for BAS 01055581 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.