3-(3-benzoyl-2-methylindolizin-1-yl)-2-cyano-N-[3-(trifluoromethyl)phenyl]prop-2-enamide
TL;DR: 3-(3-benzoyl-2-methylindolizin-1-yl)-2-cyano-N-[3-(trifluoromethyl)phenyl]prop-2-enamide (CAS 328030-59-7) is a chemical compound with molecular formula C27H18F3N3O2 and molecular weight 473.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(3-benzoyl-2-methylindolizin-1-yl)-2-cyano-N-[3-(trifluoromethyl)phenyl]prop-2-enamide
Also Known As: 3-(3-benzoyl-2-methylindolizin-1-yl)-2-cyano-N-[3-(trifluoromethyl)phenyl]prop-2-enamide, (E)-3-(3-benzoyl-2-methylindolizin-1-yl)-2-cyano-N-[3-(trifluoromethyl)phenyl]prop-2-enamide
| Molecular Formula | C27H18F3N3O2 |
|---|---|
| Molecular Weight | 473.14 g/mol |
| LogP | 6.0432 |
| Topological Polar Surface Area | 74.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 473.1351 |
| Heavy Atoms | 35 |
| Complexity | 1510.4541 |
Chemical Identifiers
| CAS Number | 328030-59-7 |
|---|---|
| SMILES | CC1=C(N2C=CC=CC2=C1/C=C(\C#N)/C(=O)NC3=CC=CC(=C3)C(F)(F)F)C(=O)C4=CC=CC=C4 |
Product Overview
3-(3-benzoyl-2-methylindolizin-1-yl)-2-cyano-N-[3-(trifluoromethyl)phenyl]prop-2-enamide (CAS 328030-59-7), with molecular formula C27H18F3N3O2 and molecular weight 473.14 g/mol. IUPAC: (E)-3-(3-benzoyl-2-methylindolizin-1-yl)-2-cyano-N-[3-(trifluoromethyl)phenyl]prop-2-enamide.
Chemical Property Profile of 3-(3-benzoyl-2-methylindolizin-1-yl)-2-cyano-N-[3-(trifluoromethyl)phenyl]prop-2-enamide
Property Insights of 3-(3-benzoyl-2-methylindolizin-1-yl)-2-cyano-N-[3-(trifluoromethyl)phenyl]prop-2-enamide
The XLogP value of 6.0432 indicates that 3-(3-benzoyl-2-methylindolizin-1-yl)-2-cyano-N-[3-(trifluoromethyl)phenyl]prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.37 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3-benzoyl-2-methylindolizin-1-yl)-2-cyano-N-[3-(trifluoromethyl)phenyl]prop-2-enamide. Following Lipinski's Rule of Five, 3-(3-benzoyl-2-methylindolizin-1-yl)-2-cyano-N-[3-(trifluoromethyl)phenyl]prop-2-enamide 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 3-(3-benzoyl-2-methylindolizin-1-yl)-2-cyano-N-[3-(trifluoromethyl)phenyl]prop-2-enamide?
The CAS number of 3-(3-benzoyl-2-methylindolizin-1-yl)-2-cyano-N-[3-(trifluoromethyl)phenyl]prop-2-enamide is 328030-59-7.
What is the molecular formula of 3-(3-benzoyl-2-methylindolizin-1-yl)-2-cyano-N-[3-(trifluoromethyl)phenyl]prop-2-enamide?
The molecular formula of 3-(3-benzoyl-2-methylindolizin-1-yl)-2-cyano-N-[3-(trifluoromethyl)phenyl]prop-2-enamide is C27H18F3N3O2.
What is the molecular weight of 3-(3-benzoyl-2-methylindolizin-1-yl)-2-cyano-N-[3-(trifluoromethyl)phenyl]prop-2-enamide?
The molecular weight of 3-(3-benzoyl-2-methylindolizin-1-yl)-2-cyano-N-[3-(trifluoromethyl)phenyl]prop-2-enamide is 473.14 g/mol.
Where can I buy 3-(3-benzoyl-2-methylindolizin-1-yl)-2-cyano-N-[3-(trifluoromethyl)phenyl]prop-2-enamide?
You can request a quote for 3-(3-benzoyl-2-methylindolizin-1-yl)-2-cyano-N-[3-(trifluoromethyl)phenyl]prop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-benzoyl-2-methylindolizin-1-yl)-2-cyano-N-[3-(trifluoromethyl)phenyl]prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-benzoyl-2-methylindolizin-1-yl)-2-cyano-N-[3-(trifluoromethyl)phenyl]prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.