1-(2,6-Dichlorophenyl)-3-(5-nitrothiophen-3-yl)urea
TL;DR: 1-(2,6-Dichlorophenyl)-3-(5-nitrothiophen-3-yl)urea (CAS 672286-03-2) is a chemical compound with molecular formula C11H7Cl2N3O3S and molecular weight 330.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,6-dichlorophenyl)-3-(5-nitrothiophen-3-yl)urea
Also Known As: 1-(2,6-dichlorophenyl)-3-(5-nitrothiophen-3-yl)urea, N-(2,6-dichlorophenyl)-N'-(5-nitro-3-thienyl)urea, 1-(2,6-dichlorophenyl)-3-(5-nitro-3-thienyl)urea, N-(2,6-Dichlorophenyl)-N'-(5-nitrothiophen-3-yl)urea, C11H7Cl2N3O3S
| Molecular Formula | C11H7Cl2N3O3S |
|---|---|
| Molecular Weight | 330.96 g/mol |
| LogP | 4.6071 |
| Topological Polar Surface Area | 84.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 330.95853 |
| Heavy Atoms | 20 |
| Complexity | 654.433 |
Chemical Identifiers
| CAS Number | 672286-03-2 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)NC(=O)NC2=CSC(=C2)[N+](=O)[O-])Cl |
Product Overview
1-(2,6-Dichlorophenyl)-3-(5-nitrothiophen-3-yl)urea (CAS 672286-03-2), with molecular formula C11H7Cl2N3O3S and molecular weight 330.96 g/mol. IUPAC: 1-(2,6-dichlorophenyl)-3-(5-nitrothiophen-3-yl)urea.
Chemical Property Profile of 1-(2,6-Dichlorophenyl)-3-(5-nitrothiophen-3-yl)urea
Property Insights of 1-(2,6-Dichlorophenyl)-3-(5-nitrothiophen-3-yl)urea
The XLogP value of 4.6071 indicates that 1-(2,6-Dichlorophenyl)-3-(5-nitrothiophen-3-yl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.27 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,6-Dichlorophenyl)-3-(5-nitrothiophen-3-yl)urea. Following Lipinski's Rule of Five, 1-(2,6-Dichlorophenyl)-3-(5-nitrothiophen-3-yl)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 1-(2,6-Dichlorophenyl)-3-(5-nitrothiophen-3-yl)urea?
The CAS number of 1-(2,6-Dichlorophenyl)-3-(5-nitrothiophen-3-yl)urea is 672286-03-2.
What is the molecular formula of 1-(2,6-Dichlorophenyl)-3-(5-nitrothiophen-3-yl)urea?
The molecular formula of 1-(2,6-Dichlorophenyl)-3-(5-nitrothiophen-3-yl)urea is C11H7Cl2N3O3S.
What is the molecular weight of 1-(2,6-Dichlorophenyl)-3-(5-nitrothiophen-3-yl)urea?
The molecular weight of 1-(2,6-Dichlorophenyl)-3-(5-nitrothiophen-3-yl)urea is 330.96 g/mol.
Where can I buy 1-(2,6-Dichlorophenyl)-3-(5-nitrothiophen-3-yl)urea?
You can request a quote for 1-(2,6-Dichlorophenyl)-3-(5-nitrothiophen-3-yl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,6-Dichlorophenyl)-3-(5-nitrothiophen-3-yl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,6-Dichlorophenyl)-3-(5-nitrothiophen-3-yl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.