(S)-3-(((Benzyloxy)carbonyl)amino)-3-phenylpropanoic acid
TL;DR: (S)-3-(((Benzyloxy)carbonyl)amino)-3-phenylpropanoic acid (CAS 14441-08-8) is a chemical compound with molecular formula C17H17NO4 and molecular weight 299.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-3-phenyl-3-(phenylmethoxycarbonylamino)propanoic acid
Also Known As: (S)-Cbz-beta3-phenylalanine, (S)-Cbz-beta-3-phenylalanine, (S)-3-(((Benzyloxy)carbonyl)amino)-3-phenylpropanoic acid, (3S)-3-phenyl-3-(phenylmethoxycarbonylamino)propanoic acid, (s)-3-(benzyloxycarbonylamino)-3-phenylpropanoic acid
| Molecular Formula | C17H17NO4 |
|---|---|
| Molecular Weight | 299.12 g/mol |
| LogP | 3.1288 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 299.11575 |
| Heavy Atoms | 22 |
| Complexity | 613.07074 |
Chemical Identifiers
| CAS Number | 14441-08-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)N[C@@H](CC(=O)O)C2=CC=CC=C2 |
Product Overview
(S)-3-(((Benzyloxy)carbonyl)amino)-3-phenylpropanoic acid (CAS 14441-08-8), with molecular formula C17H17NO4 and molecular weight 299.12 g/mol. IUPAC: (3S)-3-phenyl-3-(phenylmethoxycarbonylamino)propanoic acid.
Chemical Property Profile of (S)-3-(((Benzyloxy)carbonyl)amino)-3-phenylpropanoic acid
Property Insights of (S)-3-(((Benzyloxy)carbonyl)amino)-3-phenylpropanoic acid
The XLogP value of 3.1288 indicates that (S)-3-(((Benzyloxy)carbonyl)amino)-3-phenylpropanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.63 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-3-(((Benzyloxy)carbonyl)amino)-3-phenylpropanoic acid. Following Lipinski's Rule of Five, (S)-3-(((Benzyloxy)carbonyl)amino)-3-phenylpropanoic acid 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 (S)-3-(((Benzyloxy)carbonyl)amino)-3-phenylpropanoic acid?
The CAS number of (S)-3-(((Benzyloxy)carbonyl)amino)-3-phenylpropanoic acid is 14441-08-8.
What is the molecular formula of (S)-3-(((Benzyloxy)carbonyl)amino)-3-phenylpropanoic acid?
The molecular formula of (S)-3-(((Benzyloxy)carbonyl)amino)-3-phenylpropanoic acid is C17H17NO4.
What is the molecular weight of (S)-3-(((Benzyloxy)carbonyl)amino)-3-phenylpropanoic acid?
The molecular weight of (S)-3-(((Benzyloxy)carbonyl)amino)-3-phenylpropanoic acid is 299.12 g/mol.
Where can I buy (S)-3-(((Benzyloxy)carbonyl)amino)-3-phenylpropanoic acid?
You can request a quote for (S)-3-(((Benzyloxy)carbonyl)amino)-3-phenylpropanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-3-(((Benzyloxy)carbonyl)amino)-3-phenylpropanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (S)-3-(((Benzyloxy)carbonyl)amino)-3-phenylpropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.