N-Benzyloxycarbonyl-L-aspartic acid 4-methyl ester
TL;DR: N-Benzyloxycarbonyl-L-aspartic acid 4-methyl ester (CAS 3160-47-2) is a chemical compound with molecular formula C13H15NO6 and molecular weight 281.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-4-oxo-2-(phenylmethoxycarbonylamino)butanoic acid
Also Known As: Z-Asp(OMe)-OH, Cbz-Asp(OMe)-OH, Z-L-Aspartic acid 4-methyl ester, Z-L-aspartic acid b-methyl ester, Z-L-aspartic acid beta-methyl ester
| Molecular Formula | C13H15NO6 |
|---|---|
| Molecular Weight | 281.09 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 281.08994 |
| Heavy Atoms | 20 |
| Complexity | 351.0 |
Chemical Identifiers
| CAS Number | 3160-47-2 |
|---|---|
| SMILES | COC(=O)CC(C(=O)O)NC(=O)OCC1=CC=CC=C1 |
| InChIKey | PHMBNDDHIBIDRQ-UHFFFAOYSA-N |
Product Overview
N-Benzyloxycarbonyl-L-aspartic acid 4-methyl ester (CAS 3160-47-2), with molecular formula C13H15NO6 and molecular weight 281.09 g/mol. IUPAC: 4-methoxy-4-oxo-2-(phenylmethoxycarbonylamino)butanoic acid.
Chemical Property Profile of N-Benzyloxycarbonyl-L-aspartic acid 4-methyl ester
Property Insights of N-Benzyloxycarbonyl-L-aspartic acid 4-methyl ester
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Benzyloxycarbonyl-L-aspartic acid 4-methyl ester. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Benzyloxycarbonyl-L-aspartic acid 4-methyl ester. Following Lipinski's Rule of Five, N-Benzyloxycarbonyl-L-aspartic acid 4-methyl ester 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 N-Benzyloxycarbonyl-L-aspartic acid 4-methyl ester?
The CAS number of N-Benzyloxycarbonyl-L-aspartic acid 4-methyl ester is 3160-47-2.
What is the molecular formula of N-Benzyloxycarbonyl-L-aspartic acid 4-methyl ester?
The molecular formula of N-Benzyloxycarbonyl-L-aspartic acid 4-methyl ester is C13H15NO6.
What is the molecular weight of N-Benzyloxycarbonyl-L-aspartic acid 4-methyl ester?
The molecular weight of N-Benzyloxycarbonyl-L-aspartic acid 4-methyl ester is 281.09 g/mol.
Where can I buy N-Benzyloxycarbonyl-L-aspartic acid 4-methyl ester?
You can request a quote for N-Benzyloxycarbonyl-L-aspartic acid 4-methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Benzyloxycarbonyl-L-aspartic acid 4-methyl ester?
Yes, KEHONG BIO provides custom synthesis services for N-Benzyloxycarbonyl-L-aspartic acid 4-methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.