N-(2-Carboxyethyl)-N-nitrosourea
TL;DR: N-(2-Carboxyethyl)-N-nitrosourea (CAS 108278-71-3) is a chemical compound with molecular formula C4H7N3O4 and molecular weight 161.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[carbamoyl(nitroso)amino]propanoic acid
Also Known As: N-(2-Carboxyethyl)-N-nitrosourea, 3-[carbamoyl(nitroso)amino]propanoic acid, 3-(1-Nitrosoureido)propanoic acid, N-CARBOXYETHYL-N-NITROSOUREA, 3-(Carbamoyl(nitroso)amino)propanoicacid
| Molecular Formula | C4H7N3O4 |
|---|---|
| Molecular Weight | 161.04 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 161.04366 |
| Heavy Atoms | 11 |
| Complexity | 180.0 |
Chemical Identifiers
| CAS Number | 108278-71-3 |
|---|---|
| SMILES | C(CN(C(=O)N)N=O)C(=O)O |
| InChIKey | FADNSVDEAHIDRF-UHFFFAOYSA-N |
Product Overview
N-(2-Carboxyethyl)-N-nitrosourea (CAS 108278-71-3), with molecular formula C4H7N3O4 and molecular weight 161.04 g/mol. IUPAC: 3-[carbamoyl(nitroso)amino]propanoic acid.
Chemical Property Profile of N-(2-Carboxyethyl)-N-nitrosourea
Property Insights of N-(2-Carboxyethyl)-N-nitrosourea
The XLogP value of -0.6 indicates that N-(2-Carboxyethyl)-N-nitrosourea is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-Carboxyethyl)-N-nitrosourea. Following Lipinski's Rule of Five, N-(2-Carboxyethyl)-N-nitrosourea has 2 hydrogen bond donor(s) and 5 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-Carboxyethyl)-N-nitrosourea?
The CAS number of N-(2-Carboxyethyl)-N-nitrosourea is 108278-71-3.
What is the molecular formula of N-(2-Carboxyethyl)-N-nitrosourea?
The molecular formula of N-(2-Carboxyethyl)-N-nitrosourea is C4H7N3O4.
What is the molecular weight of N-(2-Carboxyethyl)-N-nitrosourea?
The molecular weight of N-(2-Carboxyethyl)-N-nitrosourea is 161.04 g/mol.
Where can I buy N-(2-Carboxyethyl)-N-nitrosourea?
You can request a quote for N-(2-Carboxyethyl)-N-nitrosourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-Carboxyethyl)-N-nitrosourea?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Carboxyethyl)-N-nitrosourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.