1-(1,1-dioxidotetrahydrothiophen-3-yl)-1-[(5-methylfuran-2-yl)methyl]-3-phenylurea
TL;DR: 1-(1,1-dioxidotetrahydrothiophen-3-yl)-1-[(5-methylfuran-2-yl)methyl]-3-phenylurea (CAS 838874-52-5) is a chemical compound with molecular formula C17H20N2O4S and molecular weight 348.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,1-dioxothiolan-3-yl)-1-[(5-methylfuran-2-yl)methyl]-3-phenylurea
Also Known As: 1-(1,1-dioxidotetrahydrothiophen-3-yl)-1-[(5-methylfuran-2-yl)methyl]-3-phenylurea, 1-(1,1-dioxothiolan-3-yl)-1-[(5-methylfuran-2-yl)methyl]-3-phenylurea
| Molecular Formula | C17H20N2O4S |
|---|---|
| Molecular Weight | 348.11 g/mol |
| LogP | 2.80922 |
| Topological Polar Surface Area | 79.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 348.11438 |
| Heavy Atoms | 24 |
| Complexity | 814.1259 |
Chemical Identifiers
| CAS Number | 838874-52-5 |
|---|---|
| SMILES | CC1=CC=C(O1)CN(C2CCS(=O)(=O)C2)C(=O)NC3=CC=CC=C3 |
Product Overview
1-(1,1-dioxidotetrahydrothiophen-3-yl)-1-[(5-methylfuran-2-yl)methyl]-3-phenylurea (CAS 838874-52-5), with molecular formula C17H20N2O4S and molecular weight 348.11 g/mol. IUPAC: 1-(1,1-dioxothiolan-3-yl)-1-[(5-methylfuran-2-yl)methyl]-3-phenylurea.
Chemical Property Profile of 1-(1,1-dioxidotetrahydrothiophen-3-yl)-1-[(5-methylfuran-2-yl)methyl]-3-phenylurea
Property Insights of 1-(1,1-dioxidotetrahydrothiophen-3-yl)-1-[(5-methylfuran-2-yl)methyl]-3-phenylurea
The XLogP value of 2.80922 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1,1-dioxidotetrahydrothiophen-3-yl)-1-[(5-methylfuran-2-yl)methyl]-3-phenylurea. The TPSA of 79.62 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(1,1-dioxidotetrahydrothiophen-3-yl)-1-[(5-methylfuran-2-yl)methyl]-3-phenylurea. Following Lipinski's Rule of Five, 1-(1,1-dioxidotetrahydrothiophen-3-yl)-1-[(5-methylfuran-2-yl)methyl]-3-phenylurea has 1 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-(1,1-dioxidotetrahydrothiophen-3-yl)-1-[(5-methylfuran-2-yl)methyl]-3-phenylurea?
The CAS number of 1-(1,1-dioxidotetrahydrothiophen-3-yl)-1-[(5-methylfuran-2-yl)methyl]-3-phenylurea is 838874-52-5.
What is the molecular formula of 1-(1,1-dioxidotetrahydrothiophen-3-yl)-1-[(5-methylfuran-2-yl)methyl]-3-phenylurea?
The molecular formula of 1-(1,1-dioxidotetrahydrothiophen-3-yl)-1-[(5-methylfuran-2-yl)methyl]-3-phenylurea is C17H20N2O4S.
What is the molecular weight of 1-(1,1-dioxidotetrahydrothiophen-3-yl)-1-[(5-methylfuran-2-yl)methyl]-3-phenylurea?
The molecular weight of 1-(1,1-dioxidotetrahydrothiophen-3-yl)-1-[(5-methylfuran-2-yl)methyl]-3-phenylurea is 348.11 g/mol.
Where can I buy 1-(1,1-dioxidotetrahydrothiophen-3-yl)-1-[(5-methylfuran-2-yl)methyl]-3-phenylurea?
You can request a quote for 1-(1,1-dioxidotetrahydrothiophen-3-yl)-1-[(5-methylfuran-2-yl)methyl]-3-phenylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1,1-dioxidotetrahydrothiophen-3-yl)-1-[(5-methylfuran-2-yl)methyl]-3-phenylurea?
Yes, KEHONG BIO provides custom synthesis services for 1-(1,1-dioxidotetrahydrothiophen-3-yl)-1-[(5-methylfuran-2-yl)methyl]-3-phenylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.