4-(Phenylmethyl) hydrogen N-((phenylmethoxy)carbonyl)-L-aspartate
TL;DR: 4-(Phenylmethyl) hydrogen N-((phenylmethoxy)carbonyl)-L-aspartate (CAS 3479-47-8) is a chemical compound with molecular formula C19H19NO6 and molecular weight 357.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-4-oxo-4-phenylmethoxy-2-(phenylmethoxycarbonylamino)butanoic acid
Also Known As: Z-Asp(OBzl)-OH, Cbz-Asp(OBzl)-OH, Z-Asp(OBzl), Z-L-Asp(OBzl)-OH, N-Cbz-L-aspartic Acid 4-Benzyl Ester
| Molecular Formula | C19H19NO6 |
|---|---|
| Molecular Weight | 357.12 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 357.12125 |
| Heavy Atoms | 26 |
| Complexity | 469.0 |
Chemical Identifiers
| CAS Number | 3479-47-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)C[C@@H](C(=O)O)NC(=O)OCC2=CC=CC=C2 |
| InChIKey | VUKCNAATVIWRTF-INIZCTEOSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(Phenylmethyl) hydrogen N-((phenylmethoxy)carbonyl)-L-aspartate (CAS 3479-47-8), with molecular formula C19H19NO6 and molecular weight 357.12 g/mol. IUPAC: (2S)-4-oxo-4-phenylmethoxy-2-(phenylmethoxycarbonylamino)butanoic acid.
Chemical Property Profile of 4-(Phenylmethyl) hydrogen N-((phenylmethoxy)carbonyl)-L-aspartate
Property Insights of 4-(Phenylmethyl) hydrogen N-((phenylmethoxy)carbonyl)-L-aspartate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Phenylmethyl) hydrogen N-((phenylmethoxy)carbonyl)-L-aspartate. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(Phenylmethyl) hydrogen N-((phenylmethoxy)carbonyl)-L-aspartate. Following Lipinski's Rule of Five, 4-(Phenylmethyl) hydrogen N-((phenylmethoxy)carbonyl)-L-aspartate has 2 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 4-(Phenylmethyl) hydrogen N-((phenylmethoxy)carbonyl)-L-aspartate?
The CAS number of 4-(Phenylmethyl) hydrogen N-((phenylmethoxy)carbonyl)-L-aspartate is 3479-47-8.
What is the molecular formula of 4-(Phenylmethyl) hydrogen N-((phenylmethoxy)carbonyl)-L-aspartate?
The molecular formula of 4-(Phenylmethyl) hydrogen N-((phenylmethoxy)carbonyl)-L-aspartate is C19H19NO6.
What is the molecular weight of 4-(Phenylmethyl) hydrogen N-((phenylmethoxy)carbonyl)-L-aspartate?
The molecular weight of 4-(Phenylmethyl) hydrogen N-((phenylmethoxy)carbonyl)-L-aspartate is 357.12 g/mol.
Where can I buy 4-(Phenylmethyl) hydrogen N-((phenylmethoxy)carbonyl)-L-aspartate?
You can request a quote for 4-(Phenylmethyl) hydrogen N-((phenylmethoxy)carbonyl)-L-aspartate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Phenylmethyl) hydrogen N-((phenylmethoxy)carbonyl)-L-aspartate?
Yes, KEHONG BIO provides custom synthesis services for 4-(Phenylmethyl) hydrogen N-((phenylmethoxy)carbonyl)-L-aspartate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.