N-Phenoxycarbonyl-L-valine
TL;DR: N-Phenoxycarbonyl-L-valine (CAS 126147-70-4) is a chemical compound with molecular formula C12H15NO4 and molecular weight 237.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-3-methyl-2-(phenoxycarbonylamino)butanoic acid
Also Known As: N-Phenoxycarbonyl-L-valine, L-Valine, N-(phenoxycarbonyl)-, N-(Phenoxycarbonyl)-L-valine, (S)-3-Methyl-2-((phenoxycarbonyl)amino)butanoic acid, Ritonavir Impurity 45
| Molecular Formula | C12H15NO4 |
|---|---|
| Molecular Weight | 237.10 g/mol |
| LogP | 1.8842 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 237.10011 |
| Heavy Atoms | 17 |
| Complexity | 388.75192 |
Chemical Identifiers
| CAS Number | 126147-70-4 |
|---|---|
| SMILES | CC(C)[C@@H](C(=O)O)NC(=O)OC1=CC=CC=C1 |
Product Overview
N-Phenoxycarbonyl-L-valine (CAS 126147-70-4), with molecular formula C12H15NO4 and molecular weight 237.10 g/mol. IUPAC: (2S)-3-methyl-2-(phenoxycarbonylamino)butanoic acid.
Chemical Property Profile of N-Phenoxycarbonyl-L-valine
Property Insights of N-Phenoxycarbonyl-L-valine
The XLogP value of 1.8842 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Phenoxycarbonyl-L-valine. The TPSA of 75.63 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Phenoxycarbonyl-L-valine. Following Lipinski's Rule of Five, N-Phenoxycarbonyl-L-valine has 2 hydrogen bond donor(s) and 3 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-Phenoxycarbonyl-L-valine?
The CAS number of N-Phenoxycarbonyl-L-valine is 126147-70-4.
What is the molecular formula of N-Phenoxycarbonyl-L-valine?
The molecular formula of N-Phenoxycarbonyl-L-valine is C12H15NO4.
What is the molecular weight of N-Phenoxycarbonyl-L-valine?
The molecular weight of N-Phenoxycarbonyl-L-valine is 237.10 g/mol.
Where can I buy N-Phenoxycarbonyl-L-valine?
You can request a quote for N-Phenoxycarbonyl-L-valine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Phenoxycarbonyl-L-valine?
Yes, KEHONG BIO provides custom synthesis services for N-Phenoxycarbonyl-L-valine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.