![4-nitrophenyl N2-[(benzyloxy)carbonyl]-L-asparaginate structure](/static/products/3256/3256-57-3.webp)
4-nitrophenyl N2-[(benzyloxy)carbonyl]-L-asparaginate
TL;DR: 4-nitrophenyl N2-[(benzyloxy)carbonyl]-L-asparaginate (CAS 3256-57-3) is a chemical compound with molecular formula C18H17N3O7 and molecular weight 387.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-nitrophenyl) 4-amino-4-oxo-2-(phenylmethoxycarbonylamino)butanoate
Also Known As: Z-ASN-ONP, Z-L-Asn-ONp, 5,7-Dichloro-benzofuran-3-one, Na-Z-L-asparagine 4-nitrophenyl ester, N-Cbz-L-asparagine 4-nitrophenyl ester
| Molecular Formula | C18H17N3O7 |
|---|---|
| Molecular Weight | 387.11 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 154.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 387.10666 |
| Heavy Atoms | 28 |
| Complexity | 564.0 |
Chemical Identifiers
| CAS Number | 3256-57-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)NC(CC(=O)N)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | YLWIFNIVONXXMG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-nitrophenyl N2-[(benzyloxy)carbonyl]-L-asparaginate (CAS 3256-57-3), with molecular formula C18H17N3O7 and molecular weight 387.11 g/mol. IUPAC: (4-nitrophenyl) 4-amino-4-oxo-2-(phenylmethoxycarbonylamino)butanoate.
Chemical Property Profile of 4-nitrophenyl N2-[(benzyloxy)carbonyl]-L-asparaginate
Property Insights of 4-nitrophenyl N2-[(benzyloxy)carbonyl]-L-asparaginate
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-nitrophenyl N2-[(benzyloxy)carbonyl]-L-asparaginate. The TPSA of 154.0 Ų indicates high polarity, suggesting 4-nitrophenyl N2-[(benzyloxy)carbonyl]-L-asparaginate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-nitrophenyl N2-[(benzyloxy)carbonyl]-L-asparaginate has 2 hydrogen bond donor(s) and 7 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-nitrophenyl N2-[(benzyloxy)carbonyl]-L-asparaginate?
The CAS number of 4-nitrophenyl N2-[(benzyloxy)carbonyl]-L-asparaginate is 3256-57-3.
What is the molecular formula of 4-nitrophenyl N2-[(benzyloxy)carbonyl]-L-asparaginate?
The molecular formula of 4-nitrophenyl N2-[(benzyloxy)carbonyl]-L-asparaginate is C18H17N3O7.
What is the molecular weight of 4-nitrophenyl N2-[(benzyloxy)carbonyl]-L-asparaginate?
The molecular weight of 4-nitrophenyl N2-[(benzyloxy)carbonyl]-L-asparaginate is 387.11 g/mol.
Where can I buy 4-nitrophenyl N2-[(benzyloxy)carbonyl]-L-asparaginate?
You can request a quote for 4-nitrophenyl N2-[(benzyloxy)carbonyl]-L-asparaginate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-nitrophenyl N2-[(benzyloxy)carbonyl]-L-asparaginate?
Yes, KEHONG BIO provides custom synthesis services for 4-nitrophenyl N2-[(benzyloxy)carbonyl]-L-asparaginate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.