Propenoic acid, 3-((alpha-methyl-m-trifluoromethylphenethyl)carbamoyl)-
TL;DR: Propenoic acid, 3-((alpha-methyl-m-trifluoromethylphenethyl)carbamoyl)- (CAS 73826-13-8) is a chemical compound with molecular formula C14H14F3NO3 and molecular weight 301.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-4-oxo-4-[1-[3-(trifluoromethyl)phenyl]propan-2-ylamino]but-2-enoic acid
Also Known As: Propenoic acid, 3-((alpha-methyl-m-trifluoromethylphenethyl)carbamoyl)-, 3-((alpha-Methyl-m-trifluoromethylphenethyl)amidocarbonyl)propenoic acid, (E)-4-oxo-4-[1-[3-(trifluoromethyl)phenyl]propan-2-ylamino]but-2-enoic acid, 3-({1-[3-(trifluoromethyl)phenyl]propan-2-yl}carbamoyl)prop-2-enoic acid, 3-[[alpha-Methyl-m-(trifluoromethyl)phenethyl]carbamoyl]propenoic acid
| Molecular Formula | C14H14F3NO3 |
|---|---|
| Molecular Weight | 301.09 g/mol |
| LogP | 2.3934 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 301.0926 |
| Heavy Atoms | 21 |
| Complexity | 552.6404 |
Chemical Identifiers
| CAS Number | 73826-13-8 |
|---|---|
| SMILES | CC(CC1=CC(=CC=C1)C(F)(F)F)NC(=O)/C=C/C(=O)O |
Product Overview
Propenoic acid, 3-((alpha-methyl-m-trifluoromethylphenethyl)carbamoyl)- (CAS 73826-13-8), with molecular formula C14H14F3NO3 and molecular weight 301.09 g/mol. IUPAC: (E)-4-oxo-4-[1-[3-(trifluoromethyl)phenyl]propan-2-ylamino]but-2-enoic acid.
Chemical Property Profile of Propenoic acid, 3-((alpha-methyl-m-trifluoromethylphenethyl)carbamoyl)-
Property Insights of Propenoic acid, 3-((alpha-methyl-m-trifluoromethylphenethyl)carbamoyl)-
The XLogP value of 2.3934 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propenoic acid, 3-((alpha-methyl-m-trifluoromethylphenethyl)carbamoyl)-. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Propenoic acid, 3-((alpha-methyl-m-trifluoromethylphenethyl)carbamoyl)-. Following Lipinski's Rule of Five, Propenoic acid, 3-((alpha-methyl-m-trifluoromethylphenethyl)carbamoyl)- has 2 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 Propenoic acid, 3-((alpha-methyl-m-trifluoromethylphenethyl)carbamoyl)-?
The CAS number of Propenoic acid, 3-((alpha-methyl-m-trifluoromethylphenethyl)carbamoyl)- is 73826-13-8.
What is the molecular formula of Propenoic acid, 3-((alpha-methyl-m-trifluoromethylphenethyl)carbamoyl)-?
The molecular formula of Propenoic acid, 3-((alpha-methyl-m-trifluoromethylphenethyl)carbamoyl)- is C14H14F3NO3.
What is the molecular weight of Propenoic acid, 3-((alpha-methyl-m-trifluoromethylphenethyl)carbamoyl)-?
The molecular weight of Propenoic acid, 3-((alpha-methyl-m-trifluoromethylphenethyl)carbamoyl)- is 301.09 g/mol.
Where can I buy Propenoic acid, 3-((alpha-methyl-m-trifluoromethylphenethyl)carbamoyl)-?
You can request a quote for Propenoic acid, 3-((alpha-methyl-m-trifluoromethylphenethyl)carbamoyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propenoic acid, 3-((alpha-methyl-m-trifluoromethylphenethyl)carbamoyl)-?
Yes, KEHONG BIO provides custom synthesis services for Propenoic acid, 3-((alpha-methyl-m-trifluoromethylphenethyl)carbamoyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.