1-(4-Chloro-1,1-dioxidotetrahydrothiophen-3-yl)-3-(p-tolyl)urea
TL;DR: 1-(4-Chloro-1,1-dioxidotetrahydrothiophen-3-yl)-3-(p-tolyl)urea (CAS 321580-48-7) is a chemical compound with molecular formula C12H15ClN2O3S and molecular weight 302.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chloro-1,1-dioxothiolan-3-yl)-3-(4-methylphenyl)urea
Also Known As: 1-(4-chloro-1,1-dioxothiolan-3-yl)-3-(4-methylphenyl)urea, 3-(4-chloro-1,1-dioxo-1lambda6-thiolan-3-yl)-1-(4-methylphenyl)urea, 1-(4-chloro-1,1-dioxidotetrahydrothiophen-3-yl)-3-(p-tolyl)urea, F1068-0814
| Molecular Formula | C12H15ClN2O3S |
|---|---|
| Molecular Weight | 302.05 g/mol |
| LogP | 1.52092 |
| Topological Polar Surface Area | 75.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 302.0492 |
| Heavy Atoms | 19 |
| Complexity | 571.1422 |
Chemical Identifiers
| CAS Number | 321580-48-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)NC2CS(=O)(=O)CC2Cl |
Product Overview
1-(4-Chloro-1,1-dioxidotetrahydrothiophen-3-yl)-3-(p-tolyl)urea (CAS 321580-48-7), with molecular formula C12H15ClN2O3S and molecular weight 302.05 g/mol. IUPAC: 1-(4-chloro-1,1-dioxothiolan-3-yl)-3-(4-methylphenyl)urea.
Chemical Property Profile of 1-(4-Chloro-1,1-dioxidotetrahydrothiophen-3-yl)-3-(p-tolyl)urea
Property Insights of 1-(4-Chloro-1,1-dioxidotetrahydrothiophen-3-yl)-3-(p-tolyl)urea
The XLogP value of 1.52092 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Chloro-1,1-dioxidotetrahydrothiophen-3-yl)-3-(p-tolyl)urea. The TPSA of 75.27 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Chloro-1,1-dioxidotetrahydrothiophen-3-yl)-3-(p-tolyl)urea. Following Lipinski's Rule of Five, 1-(4-Chloro-1,1-dioxidotetrahydrothiophen-3-yl)-3-(p-tolyl)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-(4-Chloro-1,1-dioxidotetrahydrothiophen-3-yl)-3-(p-tolyl)urea?
The CAS number of 1-(4-Chloro-1,1-dioxidotetrahydrothiophen-3-yl)-3-(p-tolyl)urea is 321580-48-7.
What is the molecular formula of 1-(4-Chloro-1,1-dioxidotetrahydrothiophen-3-yl)-3-(p-tolyl)urea?
The molecular formula of 1-(4-Chloro-1,1-dioxidotetrahydrothiophen-3-yl)-3-(p-tolyl)urea is C12H15ClN2O3S.
What is the molecular weight of 1-(4-Chloro-1,1-dioxidotetrahydrothiophen-3-yl)-3-(p-tolyl)urea?
The molecular weight of 1-(4-Chloro-1,1-dioxidotetrahydrothiophen-3-yl)-3-(p-tolyl)urea is 302.05 g/mol.
Where can I buy 1-(4-Chloro-1,1-dioxidotetrahydrothiophen-3-yl)-3-(p-tolyl)urea?
You can request a quote for 1-(4-Chloro-1,1-dioxidotetrahydrothiophen-3-yl)-3-(p-tolyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Chloro-1,1-dioxidotetrahydrothiophen-3-yl)-3-(p-tolyl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Chloro-1,1-dioxidotetrahydrothiophen-3-yl)-3-(p-tolyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.