![N-{[3-(trifluoromethyl)phenyl]carbamoyl}-L-leucine structure](/static/products/958/958960-77-5.png)
N-{[3-(trifluoromethyl)phenyl]carbamoyl}-L-leucine
TL;DR: N-{[3-(trifluoromethyl)phenyl]carbamoyl}-L-leucine (CAS 958960-77-5) is a chemical compound with molecular formula C14H17F3N2O3 and molecular weight 318.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-4-methyl-2-[[3-(trifluoromethyl)phenyl]carbamoylamino]pentanoic acid
Also Known As: N-{[3-(trifluoromethyl)phenyl]carbamoyl}-L-leucine, (S)-4-methyl-2-(3-(3-(trifluoromethyl)phenyl)ureido)pentanoic acid, (2S)-4-methyl-2-[[3-(trifluoromethyl)phenyl]carbamoylamino]pentanoic acid
| Molecular Formula | C14H17F3N2O3 |
|---|---|
| Molecular Weight | 318.12 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 78.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 318.11914 |
| Heavy Atoms | 22 |
| Complexity | 399.0 |
Chemical Identifiers
| CAS Number | 958960-77-5 |
|---|---|
| SMILES | CC(C)C[C@@H](C(=O)O)NC(=O)NC1=CC=CC(=C1)C(F)(F)F |
| InChIKey | XANYRWJCGMXZPH-NSHDSACASA-N |
Product Overview
N-{[3-(trifluoromethyl)phenyl]carbamoyl}-L-leucine (CAS 958960-77-5), with molecular formula C14H17F3N2O3 and molecular weight 318.12 g/mol. IUPAC: (2S)-4-methyl-2-[[3-(trifluoromethyl)phenyl]carbamoylamino]pentanoic acid.
Chemical Property Profile of N-{[3-(trifluoromethyl)phenyl]carbamoyl}-L-leucine
Property Insights of N-{[3-(trifluoromethyl)phenyl]carbamoyl}-L-leucine
The XLogP value of 3.1 indicates that N-{[3-(trifluoromethyl)phenyl]carbamoyl}-L-leucine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-{[3-(trifluoromethyl)phenyl]carbamoyl}-L-leucine. Following Lipinski's Rule of Five, N-{[3-(trifluoromethyl)phenyl]carbamoyl}-L-leucine has 3 hydrogen bond donor(s) and 6 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 N-{[3-(trifluoromethyl)phenyl]carbamoyl}-L-leucine?
The CAS number of N-{[3-(trifluoromethyl)phenyl]carbamoyl}-L-leucine is 958960-77-5.
What is the molecular formula of N-{[3-(trifluoromethyl)phenyl]carbamoyl}-L-leucine?
The molecular formula of N-{[3-(trifluoromethyl)phenyl]carbamoyl}-L-leucine is C14H17F3N2O3.
What is the molecular weight of N-{[3-(trifluoromethyl)phenyl]carbamoyl}-L-leucine?
The molecular weight of N-{[3-(trifluoromethyl)phenyl]carbamoyl}-L-leucine is 318.12 g/mol.
Where can I buy N-{[3-(trifluoromethyl)phenyl]carbamoyl}-L-leucine?
You can request a quote for N-{[3-(trifluoromethyl)phenyl]carbamoyl}-L-leucine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-{[3-(trifluoromethyl)phenyl]carbamoyl}-L-leucine?
Yes, KEHONG BIO provides custom synthesis services for N-{[3-(trifluoromethyl)phenyl]carbamoyl}-L-leucine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.