N-[2-(dimethylamino)ethyl]-N'-(4-nitrophenyl)urea
TL;DR: N-[2-(dimethylamino)ethyl]-N'-(4-nitrophenyl)urea (CAS 701926-07-0) is a chemical compound with molecular formula C11H16N4O3 and molecular weight 252.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(dimethylamino)ethyl]-3-(4-nitrophenyl)urea
Also Known As: 1-(2-dimethylaminoethyl)-3-(4-nitrophenyl)urea, 1-[2-(dimethylamino)ethyl]-3-(4-nitrophenyl)urea, N-[2-(dimethylamino)ethyl]-N'-(4-nitrophenyl)urea, N-[2-(dimethylamino)ethyl][(4-nitrophenyl)amino]carboxamide
| Molecular Formula | C11H16N4O3 |
|---|---|
| Molecular Weight | 252.12 g/mol |
| LogP | 1.2779 |
| Topological Polar Surface Area | 87.51 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 252.12224 |
| Heavy Atoms | 18 |
| Complexity | 416.80142 |
Chemical Identifiers
| CAS Number | 701926-07-0 |
|---|---|
| SMILES | CN(C)CCNC(=O)NC1=CC=C(C=C1)[N+](=O)[O-] |
Product Overview
N-[2-(dimethylamino)ethyl]-N'-(4-nitrophenyl)urea (CAS 701926-07-0), with molecular formula C11H16N4O3 and molecular weight 252.12 g/mol. IUPAC: 1-[2-(dimethylamino)ethyl]-3-(4-nitrophenyl)urea.
Chemical Property Profile of N-[2-(dimethylamino)ethyl]-N'-(4-nitrophenyl)urea
Property Insights of N-[2-(dimethylamino)ethyl]-N'-(4-nitrophenyl)urea
The XLogP value of 1.2779 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[2-(dimethylamino)ethyl]-N'-(4-nitrophenyl)urea. The TPSA of 87.51 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[2-(dimethylamino)ethyl]-N'-(4-nitrophenyl)urea. Following Lipinski's Rule of Five, N-[2-(dimethylamino)ethyl]-N'-(4-nitrophenyl)urea has 2 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-[2-(dimethylamino)ethyl]-N'-(4-nitrophenyl)urea?
The CAS number of N-[2-(dimethylamino)ethyl]-N'-(4-nitrophenyl)urea is 701926-07-0.
What is the molecular formula of N-[2-(dimethylamino)ethyl]-N'-(4-nitrophenyl)urea?
The molecular formula of N-[2-(dimethylamino)ethyl]-N'-(4-nitrophenyl)urea is C11H16N4O3.
What is the molecular weight of N-[2-(dimethylamino)ethyl]-N'-(4-nitrophenyl)urea?
The molecular weight of N-[2-(dimethylamino)ethyl]-N'-(4-nitrophenyl)urea is 252.12 g/mol.
Where can I buy N-[2-(dimethylamino)ethyl]-N'-(4-nitrophenyl)urea?
You can request a quote for N-[2-(dimethylamino)ethyl]-N'-(4-nitrophenyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-(dimethylamino)ethyl]-N'-(4-nitrophenyl)urea?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(dimethylamino)ethyl]-N'-(4-nitrophenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.