![1,1'-Ethane-1,2-diylbis[3-(4-nitrophenyl)urea] structure](/static/products/715/71540-16-4.png)
1,1'-Ethane-1,2-diylbis[3-(4-nitrophenyl)urea]
TL;DR: 1,1'-Ethane-1,2-diylbis[3-(4-nitrophenyl)urea] (CAS 71540-16-4) is a chemical compound with molecular formula C16H16N6O6 and molecular weight 388.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-nitrophenyl)-3-[2-[(4-nitrophenyl)carbamoylamino]ethyl]urea
Also Known As: 1,1'-ethane-1,2-diylbis[3-(4-nitrophenyl)urea], 1,1'-(ethane-1,2-diyl)bis(3-(4-nitrophenyl)urea), 1-(4-nitrophenyl)-3-[2-[(4-nitrophenyl)carbamoylamino]ethyl]urea, 3-(4-nitrophenyl)-1-[2-[(4-nitrophenyl)carbamoylamino]ethyl]urea, [(4-nitrophenyl)amino]-N-(2-{[(4-nitrophenyl)amino]carbonylamino}ethyl)carboxa mide
| Molecular Formula | C16H16N6O6 |
|---|---|
| Molecular Weight | 388.11 g/mol |
| LogP | 2.4462 |
| Topological Polar Surface Area | 168.54 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 388.11313 |
| Heavy Atoms | 28 |
| Complexity | 794.69836 |
Chemical Identifiers
| CAS Number | 71540-16-4 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)NCCNC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
1,1'-Ethane-1,2-diylbis[3-(4-nitrophenyl)urea] (CAS 71540-16-4), with molecular formula C16H16N6O6 and molecular weight 388.11 g/mol. IUPAC: 1-(4-nitrophenyl)-3-[2-[(4-nitrophenyl)carbamoylamino]ethyl]urea.
Chemical Property Profile of 1,1'-Ethane-1,2-diylbis[3-(4-nitrophenyl)urea]
Property Insights of 1,1'-Ethane-1,2-diylbis[3-(4-nitrophenyl)urea]
The XLogP value of 2.4462 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1'-Ethane-1,2-diylbis[3-(4-nitrophenyl)urea]. The TPSA of 168.54 Ų indicates high polarity, suggesting 1,1'-Ethane-1,2-diylbis[3-(4-nitrophenyl)urea] may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,1'-Ethane-1,2-diylbis[3-(4-nitrophenyl)urea] has 4 hydrogen bond donor(s) and 6 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 1,1'-Ethane-1,2-diylbis[3-(4-nitrophenyl)urea]?
The CAS number of 1,1'-Ethane-1,2-diylbis[3-(4-nitrophenyl)urea] is 71540-16-4.
What is the molecular formula of 1,1'-Ethane-1,2-diylbis[3-(4-nitrophenyl)urea]?
The molecular formula of 1,1'-Ethane-1,2-diylbis[3-(4-nitrophenyl)urea] is C16H16N6O6.
What is the molecular weight of 1,1'-Ethane-1,2-diylbis[3-(4-nitrophenyl)urea]?
The molecular weight of 1,1'-Ethane-1,2-diylbis[3-(4-nitrophenyl)urea] is 388.11 g/mol.
Where can I buy 1,1'-Ethane-1,2-diylbis[3-(4-nitrophenyl)urea]?
You can request a quote for 1,1'-Ethane-1,2-diylbis[3-(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 1,1'-Ethane-1,2-diylbis[3-(4-nitrophenyl)urea]?
Yes, KEHONG BIO provides custom synthesis services for 1,1'-Ethane-1,2-diylbis[3-(4-nitrophenyl)urea] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.