F0760-1813
TL;DR: F0760-1813 (CAS 477186-54-2) is a chemical compound with molecular formula C21H16F3N3S and molecular weight 399.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-3-[3-(trifluoromethyl)anilino]prop-2-enenitrile
Also Known As: F0760-1813, (E)-2-(4-(3,4-dimethylphenyl)thiazol-2-yl)-3-((3-(trifluoromethyl)phenyl)amino)acrylonitrile, (2E)-2-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-3-{[3-(trifluoromethyl)phenyl]amino}prop-2-enenitrile, (E)-2-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-3-[3-(trifluoromethyl)anilino]prop-2-enenitrile
| Molecular Formula | C21H16F3N3S |
|---|---|
| Molecular Weight | 399.10 g/mol |
| LogP | 6.42232 |
| Topological Polar Surface Area | 48.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 399.1017 |
| Heavy Atoms | 28 |
| Complexity | 1074.9852 |
Chemical Identifiers
| CAS Number | 477186-54-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C2=CSC(=N2)/C(=C/NC3=CC=CC(=C3)C(F)(F)F)/C#N)C |
Product Overview
F0760-1813 (CAS 477186-54-2), with molecular formula C21H16F3N3S and molecular weight 399.10 g/mol. IUPAC: (E)-2-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-3-[3-(trifluoromethyl)anilino]prop-2-enenitrile.
Chemical Property Profile of F0760-1813
Property Insights of F0760-1813
The XLogP value of 6.42232 indicates that F0760-1813 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.71 Ų, F0760-1813 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F0760-1813 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0760-1813?
The CAS number of F0760-1813 is 477186-54-2.
What is the molecular formula of F0760-1813?
The molecular formula of F0760-1813 is C21H16F3N3S.
What is the molecular weight of F0760-1813?
The molecular weight of F0760-1813 is 399.10 g/mol.
Where can I buy F0760-1813?
You can request a quote for F0760-1813 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0760-1813?
Yes, KEHONG BIO provides custom synthesis services for F0760-1813 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.