N,N'-Diethyl-N,N'-bis(4-nitrophenyl)urea
TL;DR: N,N'-Diethyl-N,N'-bis(4-nitrophenyl)urea (CAS 3846-49-9) is a chemical compound with molecular formula C17H18N4O5 and molecular weight 358.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-diethyl-1,3-bis(4-nitrophenyl)urea
Also Known As: 1,3-Diethyl-1,3-bis(4-nitrophenyl)urea, 1,3-diethyl-1,3-bis urea, N,N'-Diethyl-N,N'-bis(4-nitrophenyl)urea, Urea, N,N'-diethyl-N,N'-bis(4-nitrophenyl)-, Urea,N,N'-diethyl-N,N'-bis(4-nitrophenyl)-
| Molecular Formula | C17H18N4O5 |
|---|---|
| Molecular Weight | 358.13 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 358.12772 |
| Heavy Atoms | 26 |
| Complexity | 458.0 |
Chemical Identifiers
| CAS Number | 3846-49-9 |
|---|---|
| SMILES | CCN(C1=CC=C(C=C1)[N+](=O)[O-])C(=O)N(CC)C2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | PJTRUXHYQYQMTG-UHFFFAOYSA-N |
Product Overview
N,N'-Diethyl-N,N'-bis(4-nitrophenyl)urea (CAS 3846-49-9), with molecular formula C17H18N4O5 and molecular weight 358.13 g/mol. IUPAC: 1,3-diethyl-1,3-bis(4-nitrophenyl)urea.
Chemical Property Profile of N,N'-Diethyl-N,N'-bis(4-nitrophenyl)urea
Property Insights of N,N'-Diethyl-N,N'-bis(4-nitrophenyl)urea
The XLogP value of 3.2 indicates that N,N'-Diethyl-N,N'-bis(4-nitrophenyl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N'-Diethyl-N,N'-bis(4-nitrophenyl)urea. Following Lipinski's Rule of Five, N,N'-Diethyl-N,N'-bis(4-nitrophenyl)urea has 0 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,N'-Diethyl-N,N'-bis(4-nitrophenyl)urea?
The CAS number of N,N'-Diethyl-N,N'-bis(4-nitrophenyl)urea is 3846-49-9.
What is the molecular formula of N,N'-Diethyl-N,N'-bis(4-nitrophenyl)urea?
The molecular formula of N,N'-Diethyl-N,N'-bis(4-nitrophenyl)urea is C17H18N4O5.
What is the molecular weight of N,N'-Diethyl-N,N'-bis(4-nitrophenyl)urea?
The molecular weight of N,N'-Diethyl-N,N'-bis(4-nitrophenyl)urea is 358.13 g/mol.
Where can I buy N,N'-Diethyl-N,N'-bis(4-nitrophenyl)urea?
You can request a quote for N,N'-Diethyl-N,N'-bis(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,N'-Diethyl-N,N'-bis(4-nitrophenyl)urea?
Yes, KEHONG BIO provides custom synthesis services for N,N'-Diethyl-N,N'-bis(4-nitrophenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.