N(2)-benzyloxycarbonylarginine-4-nitrophenyl ester
TL;DR: N(2)-benzyloxycarbonylarginine-4-nitrophenyl ester (CAS 79386-90-6) is a chemical compound with molecular formula C20H23N5O6 and molecular weight 429.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-nitrophenyl) (2S)-5-(diaminomethylideneamino)-2-(phenylmethoxycarbonylamino)pentanoate
Also Known As: Sid 769290, N(2)-Benzyloxycarbonylarginine-4-nitrophenyl ester, N(2)-((Phenylmethoxy)carbonyl)arginine 4-nitrophenyl ester, N-alpha-Carbobenzoxy-arginine p-nitrophenyl ester, N-alpha-Carbobenzoxy-L-arginine p-nitrophenyl ester
| Molecular Formula | C20H23N5O6 |
|---|---|
| Molecular Weight | 429.16 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 175.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 429.16483 |
| Heavy Atoms | 31 |
| Complexity | 620.0 |
Chemical Identifiers
| CAS Number | 79386-90-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)N[C@@H](CCCN=C(N)N)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | UXGFJYQFSUTKFH-KRWDZBQOSA-N |
Product Overview
N(2)-benzyloxycarbonylarginine-4-nitrophenyl ester (CAS 79386-90-6), with molecular formula C20H23N5O6 and molecular weight 429.16 g/mol. IUPAC: (4-nitrophenyl) (2S)-5-(diaminomethylideneamino)-2-(phenylmethoxycarbonylamino)pentanoate.
Chemical Property Profile of N(2)-benzyloxycarbonylarginine-4-nitrophenyl ester
Property Insights of N(2)-benzyloxycarbonylarginine-4-nitrophenyl ester
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N(2)-benzyloxycarbonylarginine-4-nitrophenyl ester. The TPSA of 175.0 Ų indicates high polarity, suggesting N(2)-benzyloxycarbonylarginine-4-nitrophenyl ester may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N(2)-benzyloxycarbonylarginine-4-nitrophenyl ester has 3 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 N(2)-benzyloxycarbonylarginine-4-nitrophenyl ester?
The CAS number of N(2)-benzyloxycarbonylarginine-4-nitrophenyl ester is 79386-90-6.
What is the molecular formula of N(2)-benzyloxycarbonylarginine-4-nitrophenyl ester?
The molecular formula of N(2)-benzyloxycarbonylarginine-4-nitrophenyl ester is C20H23N5O6.
What is the molecular weight of N(2)-benzyloxycarbonylarginine-4-nitrophenyl ester?
The molecular weight of N(2)-benzyloxycarbonylarginine-4-nitrophenyl ester is 429.16 g/mol.
Where can I buy N(2)-benzyloxycarbonylarginine-4-nitrophenyl ester?
You can request a quote for N(2)-benzyloxycarbonylarginine-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 N(2)-benzyloxycarbonylarginine-4-nitrophenyl ester?
Yes, KEHONG BIO provides custom synthesis services for N(2)-benzyloxycarbonylarginine-4-nitrophenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.