N-methoxycarbonylphenylalanylglycine 4-nitrophenyl ester
TL;DR: N-methoxycarbonylphenylalanylglycine 4-nitrophenyl ester (CAS 82080-92-0) is a chemical compound with molecular formula C19H19N3O7 and molecular weight 401.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-nitrophenyl) 2-[[(2S)-2-(methoxycarbonylamino)-3-phenylpropanoyl]amino]acetate
Also Known As: Meo-phe-gly-nph, N-Methoxycarbonyl-phe-gly-4-nitrophenyl ester, N-Methoxycarbonylphenylalanylglycine 4-nitrophenyl ester, N-methoxycarbonylphenylalanylglycine4-nitrophenylester, N-Methoxycarbony-L-phenylalanylglycine para-nitrophenyl ester
| Molecular Formula | C19H19N3O7 |
|---|---|
| Molecular Weight | 401.12 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 140.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 401.1223 |
| Heavy Atoms | 29 |
| Complexity | 579.0 |
Chemical Identifiers
| CAS Number | 82080-92-0 |
|---|---|
| SMILES | COC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCC(=O)OC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | GNFKUGVEOZAMPC-INIZCTEOSA-N |
Product Overview
N-methoxycarbonylphenylalanylglycine 4-nitrophenyl ester (CAS 82080-92-0), with molecular formula C19H19N3O7 and molecular weight 401.12 g/mol. IUPAC: (4-nitrophenyl) 2-[[(2S)-2-(methoxycarbonylamino)-3-phenylpropanoyl]amino]acetate.
Chemical Property Profile of N-methoxycarbonylphenylalanylglycine 4-nitrophenyl ester
Property Insights of N-methoxycarbonylphenylalanylglycine 4-nitrophenyl ester
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-methoxycarbonylphenylalanylglycine 4-nitrophenyl ester. The TPSA of 140.0 Ų indicates high polarity, suggesting N-methoxycarbonylphenylalanylglycine 4-nitrophenyl ester may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-methoxycarbonylphenylalanylglycine 4-nitrophenyl ester 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 N-methoxycarbonylphenylalanylglycine 4-nitrophenyl ester?
The CAS number of N-methoxycarbonylphenylalanylglycine 4-nitrophenyl ester is 82080-92-0.
What is the molecular formula of N-methoxycarbonylphenylalanylglycine 4-nitrophenyl ester?
The molecular formula of N-methoxycarbonylphenylalanylglycine 4-nitrophenyl ester is C19H19N3O7.
What is the molecular weight of N-methoxycarbonylphenylalanylglycine 4-nitrophenyl ester?
The molecular weight of N-methoxycarbonylphenylalanylglycine 4-nitrophenyl ester is 401.12 g/mol.
Where can I buy N-methoxycarbonylphenylalanylglycine 4-nitrophenyl ester?
You can request a quote for N-methoxycarbonylphenylalanylglycine 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-methoxycarbonylphenylalanylglycine 4-nitrophenyl ester?
Yes, KEHONG BIO provides custom synthesis services for N-methoxycarbonylphenylalanylglycine 4-nitrophenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.