![N-{[(4-nitrophenyl)amino]carbonyl}alanine structure](/static/products/6883/688334-02-3.webp)
N-{[(4-nitrophenyl)amino]carbonyl}alanine
TL;DR: N-{[(4-nitrophenyl)amino]carbonyl}alanine (CAS 688334-02-3) is a chemical compound with molecular formula C10H11N3O5 and molecular weight 253.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-nitrophenyl)carbamoylamino]propanoic acid
Also Known As: N-{[(4-nitrophenyl)amino]carbonyl}alanine, ((4-Nitrophenyl)carbamoyl)alanine, 2-[(4-nitrophenyl)carbamoylamino]propanoic Acid, N-([(4-Nitrophenyl)amino]carbonyl)alanine, N-{(4-Nitrophenyl)aminocarbonyl}alanine
| Molecular Formula | C10H11N3O5 |
|---|---|
| Molecular Weight | 253.07 g/mol |
| LogP | 1.1894 |
| Topological Polar Surface Area | 121.57 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 253.06987 |
| Heavy Atoms | 18 |
| Complexity | 470.90643 |
Chemical Identifiers
| CAS Number | 688334-02-3 |
|---|---|
| SMILES | CC(C(=O)O)NC(=O)NC1=CC=C(C=C1)[N+](=O)[O-] |
Product Overview
N-{[(4-nitrophenyl)amino]carbonyl}alanine (CAS 688334-02-3), with molecular formula C10H11N3O5 and molecular weight 253.07 g/mol. IUPAC: 2-[(4-nitrophenyl)carbamoylamino]propanoic acid.
Chemical Property Profile of N-{[(4-nitrophenyl)amino]carbonyl}alanine
Property Insights of N-{[(4-nitrophenyl)amino]carbonyl}alanine
The XLogP value of 1.1894 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-{[(4-nitrophenyl)amino]carbonyl}alanine. The TPSA of 121.57 Ų falls within the moderate polarity range, balancing permeability and solubility for N-{[(4-nitrophenyl)amino]carbonyl}alanine. Following Lipinski's Rule of Five, N-{[(4-nitrophenyl)amino]carbonyl}alanine has 3 hydrogen bond donor(s) and 4 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-{[(4-nitrophenyl)amino]carbonyl}alanine?
The CAS number of N-{[(4-nitrophenyl)amino]carbonyl}alanine is 688334-02-3.
What is the molecular formula of N-{[(4-nitrophenyl)amino]carbonyl}alanine?
The molecular formula of N-{[(4-nitrophenyl)amino]carbonyl}alanine is C10H11N3O5.
What is the molecular weight of N-{[(4-nitrophenyl)amino]carbonyl}alanine?
The molecular weight of N-{[(4-nitrophenyl)amino]carbonyl}alanine is 253.07 g/mol.
Where can I buy N-{[(4-nitrophenyl)amino]carbonyl}alanine?
You can request a quote for N-{[(4-nitrophenyl)amino]carbonyl}alanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-{[(4-nitrophenyl)amino]carbonyl}alanine?
Yes, KEHONG BIO provides custom synthesis services for N-{[(4-nitrophenyl)amino]carbonyl}alanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.