N(alpha)-Benzyloxycarbonylphenylalanylchloromethane
TL;DR: N(alpha)-Benzyloxycarbonylphenylalanylchloromethane (CAS 26049-98-9) is a chemical compound with molecular formula C18H18ClNO3 and molecular weight 331.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl N-(4-chloro-3-oxo-1-phenylbutan-2-yl)carbamate
Also Known As: ZPCK, Z-L-Phe chloromethyl ketone, Z-Phe-chloromethylketone, Carbamic acid, benzyl ester, Carbamic acid, benzyl ester, L-
| Molecular Formula | C18H18ClNO3 |
|---|---|
| Molecular Weight | 331.10 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 331.09753 |
| Heavy Atoms | 23 |
| Complexity | 376.0 |
Chemical Identifiers
| CAS Number | 26049-98-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC(C(=O)CCl)NC(=O)OCC2=CC=CC=C2 |
| InChIKey | OYHLRJGDELITAF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N(alpha)-Benzyloxycarbonylphenylalanylchloromethane (CAS 26049-98-9), with molecular formula C18H18ClNO3 and molecular weight 331.10 g/mol. IUPAC: benzyl N-(4-chloro-3-oxo-1-phenylbutan-2-yl)carbamate.
Chemical Property Profile of N(alpha)-Benzyloxycarbonylphenylalanylchloromethane
Property Insights of N(alpha)-Benzyloxycarbonylphenylalanylchloromethane
The XLogP value of 3.8 indicates that N(alpha)-Benzyloxycarbonylphenylalanylchloromethane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, N(alpha)-Benzyloxycarbonylphenylalanylchloromethane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N(alpha)-Benzyloxycarbonylphenylalanylchloromethane has 1 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(alpha)-Benzyloxycarbonylphenylalanylchloromethane?
The CAS number of N(alpha)-Benzyloxycarbonylphenylalanylchloromethane is 26049-98-9.
What is the molecular formula of N(alpha)-Benzyloxycarbonylphenylalanylchloromethane?
The molecular formula of N(alpha)-Benzyloxycarbonylphenylalanylchloromethane is C18H18ClNO3.
What is the molecular weight of N(alpha)-Benzyloxycarbonylphenylalanylchloromethane?
The molecular weight of N(alpha)-Benzyloxycarbonylphenylalanylchloromethane is 331.10 g/mol.
Where can I buy N(alpha)-Benzyloxycarbonylphenylalanylchloromethane?
You can request a quote for N(alpha)-Benzyloxycarbonylphenylalanylchloromethane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N(alpha)-Benzyloxycarbonylphenylalanylchloromethane?
Yes, KEHONG BIO provides custom synthesis services for N(alpha)-Benzyloxycarbonylphenylalanylchloromethane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.