1-(3,4-Dichlorophenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea
TL;DR: 1-(3,4-Dichlorophenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea (CAS 630065-22-4) is a chemical compound with molecular formula C11H12Cl2N2O3S and molecular weight 321.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-dichlorophenyl)-3-(1,1-dioxothiolan-3-yl)urea
Also Known As: BAS 07786631, 1-(3,4-dichlorophenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea, 1-(3,4-dichlorophenyl)-3-(1,1-dioxothiolan-3-yl)urea, 1-(3,4-Dichloro-phenyl)-3-(1,1-dioxo-tetrahydro-1lambda*6*-thiophen-3-yl)-urea, N-(3,4-Dichlorophenyl)-N'-(1,1-dioxo-1lambda~6~-thiolan-3-yl)urea
| Molecular Formula | C11H12Cl2N2O3S |
|---|---|
| Molecular Weight | 321.99 g/mol |
| LogP | 2.302 |
| Topological Polar Surface Area | 75.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 321.99457 |
| Heavy Atoms | 19 |
| Complexity | 603.9579 |
Chemical Identifiers
| CAS Number | 630065-22-4 |
|---|---|
| SMILES | C1CS(=O)(=O)CC1NC(=O)NC2=CC(=C(C=C2)Cl)Cl |
Product Overview
1-(3,4-Dichlorophenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea (CAS 630065-22-4), with molecular formula C11H12Cl2N2O3S and molecular weight 321.99 g/mol. IUPAC: 1-(3,4-dichlorophenyl)-3-(1,1-dioxothiolan-3-yl)urea.
Chemical Property Profile of 1-(3,4-Dichlorophenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea
Property Insights of 1-(3,4-Dichlorophenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea
The XLogP value of 2.302 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3,4-Dichlorophenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea. The TPSA of 75.27 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3,4-Dichlorophenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea. Following Lipinski's Rule of Five, 1-(3,4-Dichlorophenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea has 2 hydrogen bond donor(s) and 3 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-(3,4-Dichlorophenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea?
The CAS number of 1-(3,4-Dichlorophenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea is 630065-22-4.
What is the molecular formula of 1-(3,4-Dichlorophenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea?
The molecular formula of 1-(3,4-Dichlorophenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea is C11H12Cl2N2O3S.
What is the molecular weight of 1-(3,4-Dichlorophenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea?
The molecular weight of 1-(3,4-Dichlorophenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea is 321.99 g/mol.
Where can I buy 1-(3,4-Dichlorophenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea?
You can request a quote for 1-(3,4-Dichlorophenyl)-3-(1,1-dioxidotetrahydrothiophen-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-(3,4-Dichlorophenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,4-Dichlorophenyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.