Alanine, N-benzyloxycarbonyl-3-phenyl-, cyanomethyl ester, L-
TL;DR: Alanine, N-benzyloxycarbonyl-3-phenyl-, cyanomethyl ester, L- (CAS 7663-85-6) is a chemical compound with molecular formula C19H18N2O4 and molecular weight 338.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyanomethyl (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoate
Also Known As: Z-L-Phe-OCH2CN, L-N-Benzyloxycarbonyl-3-phenylalanine cyanomethyl ester, ALANINE, N-BENZYLOXYCARBONYL-3-PHENYL-, CYANOMETHYL ESTER, L-, N-(carbobenzyloxy)phenylalanine cyanomethyl ester, Cyanomethyl N-[(benzyloxy)carbonyl]-L-phenylalaninate
| Molecular Formula | C19H18N2O4 |
|---|---|
| Molecular Weight | 338.13 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 88.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 338.12665 |
| Heavy Atoms | 25 |
| Complexity | 473.0 |
Chemical Identifiers
| CAS Number | 7663-85-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)C[C@@H](C(=O)OCC#N)NC(=O)OCC2=CC=CC=C2 |
| InChIKey | QDAFQGLLNQPQAT-KRWDZBQOSA-N |
Product Overview
Alanine, N-benzyloxycarbonyl-3-phenyl-, cyanomethyl ester, L- (CAS 7663-85-6), with molecular formula C19H18N2O4 and molecular weight 338.13 g/mol. IUPAC: cyanomethyl (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoate.
Chemical Property Profile of Alanine, N-benzyloxycarbonyl-3-phenyl-, cyanomethyl ester, L-
Property Insights of Alanine, N-benzyloxycarbonyl-3-phenyl-, cyanomethyl ester, L-
The XLogP value of 3.1 indicates that Alanine, N-benzyloxycarbonyl-3-phenyl-, cyanomethyl ester, L- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Alanine, N-benzyloxycarbonyl-3-phenyl-, cyanomethyl ester, L-. Following Lipinski's Rule of Five, Alanine, N-benzyloxycarbonyl-3-phenyl-, cyanomethyl ester, L- has 1 hydrogen bond donor(s) and 5 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 Alanine, N-benzyloxycarbonyl-3-phenyl-, cyanomethyl ester, L-?
The CAS number of Alanine, N-benzyloxycarbonyl-3-phenyl-, cyanomethyl ester, L- is 7663-85-6.
What is the molecular formula of Alanine, N-benzyloxycarbonyl-3-phenyl-, cyanomethyl ester, L-?
The molecular formula of Alanine, N-benzyloxycarbonyl-3-phenyl-, cyanomethyl ester, L- is C19H18N2O4.
What is the molecular weight of Alanine, N-benzyloxycarbonyl-3-phenyl-, cyanomethyl ester, L-?
The molecular weight of Alanine, N-benzyloxycarbonyl-3-phenyl-, cyanomethyl ester, L- is 338.13 g/mol.
Where can I buy Alanine, N-benzyloxycarbonyl-3-phenyl-, cyanomethyl ester, L-?
You can request a quote for Alanine, N-benzyloxycarbonyl-3-phenyl-, cyanomethyl ester, L- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Alanine, N-benzyloxycarbonyl-3-phenyl-, cyanomethyl ester, L-?
Yes, KEHONG BIO provides custom synthesis services for Alanine, N-benzyloxycarbonyl-3-phenyl-, cyanomethyl ester, L- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.