1-(4-Methoxyphenyl)-3-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)urea
TL;DR: 1-(4-Methoxyphenyl)-3-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)urea (CAS 507256-36-2) is a chemical compound with molecular formula C13H18N2O4S and molecular weight 298.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methoxyphenyl)-3-(3-methyl-1,1-dioxothiolan-3-yl)urea
Also Known As: BAS 05438085, 1-(4-methoxyphenyl)-3-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)urea, 1-(4-methoxyphenyl)-3-(3-methyl-1,1-dioxothiolan-3-yl)urea, [(4-methoxyphenyl)amino]-N-(3-methyl-1,1-dioxothiolan-3-yl)carboxamide, 1-(4-Methoxy-phenyl)-3-(3-methyl-1,1-dioxo-tetrahydro-1lambda*6*-thiophen-3-yl)-urea
| Molecular Formula | C13H18N2O4S |
|---|---|
| Molecular Weight | 298.10 g/mol |
| LogP | 1.3939 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 298.09872 |
| Heavy Atoms | 20 |
| Complexity | 597.3021 |
Chemical Identifiers
| CAS Number | 507256-36-2 |
|---|---|
| SMILES | CC1(CCS(=O)(=O)C1)NC(=O)NC2=CC=C(C=C2)OC |
Product Overview
1-(4-Methoxyphenyl)-3-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)urea (CAS 507256-36-2), with molecular formula C13H18N2O4S and molecular weight 298.10 g/mol. IUPAC: 1-(4-methoxyphenyl)-3-(3-methyl-1,1-dioxothiolan-3-yl)urea.
Chemical Property Profile of 1-(4-Methoxyphenyl)-3-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)urea
Property Insights of 1-(4-Methoxyphenyl)-3-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)urea
The XLogP value of 1.3939 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Methoxyphenyl)-3-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)urea. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Methoxyphenyl)-3-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)urea. Following Lipinski's Rule of Five, 1-(4-Methoxyphenyl)-3-(3-methyl-1,1-dioxidotetrahydrothiophen-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-(4-Methoxyphenyl)-3-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)urea?
The CAS number of 1-(4-Methoxyphenyl)-3-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)urea is 507256-36-2.
What is the molecular formula of 1-(4-Methoxyphenyl)-3-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)urea?
The molecular formula of 1-(4-Methoxyphenyl)-3-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)urea is C13H18N2O4S.
What is the molecular weight of 1-(4-Methoxyphenyl)-3-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)urea?
The molecular weight of 1-(4-Methoxyphenyl)-3-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)urea is 298.10 g/mol.
Where can I buy 1-(4-Methoxyphenyl)-3-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)urea?
You can request a quote for 1-(4-Methoxyphenyl)-3-(3-methyl-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-(4-Methoxyphenyl)-3-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Methoxyphenyl)-3-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.