Cbz-L-Aspartic Acid 4-Benzyl 1-(4-nitrophenyl) Ester
TL;DR: Cbz-L-Aspartic Acid 4-Benzyl 1-(4-nitrophenyl) Ester (CAS 2419-54-7) is a chemical compound with molecular formula C25H22N2O8 and molecular weight 478.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-O-benzyl 1-O-(4-nitrophenyl) 2-(phenylmethoxycarbonylamino)butanedioate
Also Known As: Cbz-L-Aspartic Acid 4-Benzyl 1-(4-nitrophenyl) Ester, Z-L-aspartic acid beta-benzyl alpha-(4-nitrophenyl) ester, (4-nitrophenyl) Benzyl 2-phenylmethoxycarbonylaminobutanedioate, 4-Benzyl 1-(4-nitrophenyl) ((benzyloxy)carbonyl)-L-aspartate, z-L-Aspartic acid beta-benzyl ester alpha-4-nitrophenyl ester
| Molecular Formula | C25H22N2O8 |
|---|---|
| Molecular Weight | 478.14 g/mol |
| LogP | 3.9287 |
| Topological Polar Surface Area | 134.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 478.1376 |
| Heavy Atoms | 35 |
| Complexity | 1093.6039 |
Chemical Identifiers
| CAS Number | 2419-54-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)CC(C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)OCC3=CC=CC=C3 |
Product Overview
Cbz-L-Aspartic Acid 4-Benzyl 1-(4-nitrophenyl) Ester (CAS 2419-54-7), with molecular formula C25H22N2O8 and molecular weight 478.14 g/mol. IUPAC: 4-O-benzyl 1-O-(4-nitrophenyl) 2-(phenylmethoxycarbonylamino)butanedioate.
Chemical Property Profile of Cbz-L-Aspartic Acid 4-Benzyl 1-(4-nitrophenyl) Ester
Property Insights of Cbz-L-Aspartic Acid 4-Benzyl 1-(4-nitrophenyl) Ester
The XLogP value of 3.9287 indicates that Cbz-L-Aspartic Acid 4-Benzyl 1-(4-nitrophenyl) Ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 134.07 Ų falls within the moderate polarity range, balancing permeability and solubility for Cbz-L-Aspartic Acid 4-Benzyl 1-(4-nitrophenyl) Ester. Following Lipinski's Rule of Five, Cbz-L-Aspartic Acid 4-Benzyl 1-(4-nitrophenyl) Ester has 1 hydrogen bond donor(s) and 8 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 Cbz-L-Aspartic Acid 4-Benzyl 1-(4-nitrophenyl) Ester?
The CAS number of Cbz-L-Aspartic Acid 4-Benzyl 1-(4-nitrophenyl) Ester is 2419-54-7.
What is the molecular formula of Cbz-L-Aspartic Acid 4-Benzyl 1-(4-nitrophenyl) Ester?
The molecular formula of Cbz-L-Aspartic Acid 4-Benzyl 1-(4-nitrophenyl) Ester is C25H22N2O8.
What is the molecular weight of Cbz-L-Aspartic Acid 4-Benzyl 1-(4-nitrophenyl) Ester?
The molecular weight of Cbz-L-Aspartic Acid 4-Benzyl 1-(4-nitrophenyl) Ester is 478.14 g/mol.
Where can I buy Cbz-L-Aspartic Acid 4-Benzyl 1-(4-nitrophenyl) Ester?
You can request a quote for Cbz-L-Aspartic Acid 4-Benzyl 1-(4-nitrophenyl) Ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cbz-L-Aspartic Acid 4-Benzyl 1-(4-nitrophenyl) Ester?
Yes, KEHONG BIO provides custom synthesis services for Cbz-L-Aspartic Acid 4-Benzyl 1-(4-nitrophenyl) Ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.