Urea, 1-(methylsulfonyl)-3-phenyl-2-thio-
TL;DR: Urea, 1-(methylsulfonyl)-3-phenyl-2-thio- (CAS 6171-11-5) is a chemical compound with molecular formula C8H10N2O2S2 and molecular weight 230.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methylsulfonyl-3-phenylthiourea
Also Known As: 1-Methylsulfonyl-3- thiourea, 1-methylsulfonyl-3-phenylthiourea, 3-methanesulfonyl-1-phenylthiourea, 1-Methylsulfonyl-3-(phenyl)thiourea, N-(phenylcarbamothioyl)methanesulfonamide
| Molecular Formula | C8H10N2O2S2 |
|---|---|
| Molecular Weight | 230.02 g/mol |
| LogP | 0.9326 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 230.01837 |
| Heavy Atoms | 14 |
| Complexity | 414.22723 |
Chemical Identifiers
| CAS Number | 6171-11-5 |
|---|---|
| SMILES | CS(=O)(=O)NC(=S)NC1=CC=CC=C1 |
Product Overview
Urea, 1-(methylsulfonyl)-3-phenyl-2-thio- (CAS 6171-11-5), with molecular formula C8H10N2O2S2 and molecular weight 230.02 g/mol. IUPAC: 1-methylsulfonyl-3-phenylthiourea.
Chemical Property Profile of Urea, 1-(methylsulfonyl)-3-phenyl-2-thio-
Property Insights of Urea, 1-(methylsulfonyl)-3-phenyl-2-thio-
The XLogP value of 0.9326 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, 1-(methylsulfonyl)-3-phenyl-2-thio-. With a topological polar surface area (TPSA) of 58.2 Ų, Urea, 1-(methylsulfonyl)-3-phenyl-2-thio- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Urea, 1-(methylsulfonyl)-3-phenyl-2-thio- 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 Urea, 1-(methylsulfonyl)-3-phenyl-2-thio-?
The CAS number of Urea, 1-(methylsulfonyl)-3-phenyl-2-thio- is 6171-11-5.
What is the molecular formula of Urea, 1-(methylsulfonyl)-3-phenyl-2-thio-?
The molecular formula of Urea, 1-(methylsulfonyl)-3-phenyl-2-thio- is C8H10N2O2S2.
What is the molecular weight of Urea, 1-(methylsulfonyl)-3-phenyl-2-thio-?
The molecular weight of Urea, 1-(methylsulfonyl)-3-phenyl-2-thio- is 230.02 g/mol.
Where can I buy Urea, 1-(methylsulfonyl)-3-phenyl-2-thio-?
You can request a quote for Urea, 1-(methylsulfonyl)-3-phenyl-2-thio- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, 1-(methylsulfonyl)-3-phenyl-2-thio-?
Yes, KEHONG BIO provides custom synthesis services for Urea, 1-(methylsulfonyl)-3-phenyl-2-thio- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.