![1-[2-(4-Bromoanilino)cyclohex-1-en-1-yl]-2,2,2-trifluoroethan-1-one structure](/static/products/6015/6015-59-4.webp)
1-[2-(4-Bromoanilino)cyclohex-1-en-1-yl]-2,2,2-trifluoroethan-1-one
TL;DR: 1-[2-(4-Bromoanilino)cyclohex-1-en-1-yl]-2,2,2-trifluoroethan-1-one (CAS 6015-59-4) is a chemical compound with molecular formula C14H13BrF3NO and molecular weight 347.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(4-bromoanilino)cyclohexen-1-yl]-2,2,2-trifluoroethanone
Also Known As: BIM-0040792.P001, J2.792.492A, 1-[2-(4-bromoanilino)cyclohexen-1-yl]-2,2,2-trifluoroethanone, 1-{2-[(4-bromophenyl)amino]-1-cyclohexen-1-yl}-2,2,2-trifluoroethanone, 1-[2-(4-Bromoanilino)cyclohex-1-en-1-yl]-2,2,2-trifluoroethan-1-one
| Molecular Formula | C14H13BrF3NO |
|---|---|
| Molecular Weight | 347.01 g/mol |
| LogP | 4.8205 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 347.01328 |
| Heavy Atoms | 20 |
| Complexity | 534.34515 |
Chemical Identifiers
| CAS Number | 6015-59-4 |
|---|---|
| SMILES | C1CCC(=C(C1)C(=O)C(F)(F)F)NC2=CC=C(C=C2)Br |
Product Overview
1-[2-(4-Bromoanilino)cyclohex-1-en-1-yl]-2,2,2-trifluoroethan-1-one (CAS 6015-59-4), with molecular formula C14H13BrF3NO and molecular weight 347.01 g/mol. IUPAC: 1-[2-(4-bromoanilino)cyclohexen-1-yl]-2,2,2-trifluoroethanone.
Chemical Property Profile of 1-[2-(4-Bromoanilino)cyclohex-1-en-1-yl]-2,2,2-trifluoroethan-1-one
Property Insights of 1-[2-(4-Bromoanilino)cyclohex-1-en-1-yl]-2,2,2-trifluoroethan-1-one
The XLogP value of 4.8205 indicates that 1-[2-(4-Bromoanilino)cyclohex-1-en-1-yl]-2,2,2-trifluoroethan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 1-[2-(4-Bromoanilino)cyclohex-1-en-1-yl]-2,2,2-trifluoroethan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[2-(4-Bromoanilino)cyclohex-1-en-1-yl]-2,2,2-trifluoroethan-1-one has 1 hydrogen bond donor(s) and 2 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 1-[2-(4-Bromoanilino)cyclohex-1-en-1-yl]-2,2,2-trifluoroethan-1-one?
The CAS number of 1-[2-(4-Bromoanilino)cyclohex-1-en-1-yl]-2,2,2-trifluoroethan-1-one is 6015-59-4.
What is the molecular formula of 1-[2-(4-Bromoanilino)cyclohex-1-en-1-yl]-2,2,2-trifluoroethan-1-one?
The molecular formula of 1-[2-(4-Bromoanilino)cyclohex-1-en-1-yl]-2,2,2-trifluoroethan-1-one is C14H13BrF3NO.
What is the molecular weight of 1-[2-(4-Bromoanilino)cyclohex-1-en-1-yl]-2,2,2-trifluoroethan-1-one?
The molecular weight of 1-[2-(4-Bromoanilino)cyclohex-1-en-1-yl]-2,2,2-trifluoroethan-1-one is 347.01 g/mol.
Where can I buy 1-[2-(4-Bromoanilino)cyclohex-1-en-1-yl]-2,2,2-trifluoroethan-1-one?
You can request a quote for 1-[2-(4-Bromoanilino)cyclohex-1-en-1-yl]-2,2,2-trifluoroethan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[2-(4-Bromoanilino)cyclohex-1-en-1-yl]-2,2,2-trifluoroethan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-[2-(4-Bromoanilino)cyclohex-1-en-1-yl]-2,2,2-trifluoroethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.