1-Methyl-1-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-naphthalen-1-ylurea
TL;DR: 1-Methyl-1-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-naphthalen-1-ylurea (CAS 428451-60-9) is a chemical compound with molecular formula C17H20N2O3S and molecular weight 332.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-1-(3-methyl-1,1-dioxothiolan-3-yl)-3-naphthalen-1-ylurea
Also Known As: BAS 06977934, 1-methyl-1-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-naphthalen-1-ylurea, [methyl(3-methyl-1,1-dioxothiolan-3-yl)amino]-N-naphthylcarboxamide, 1-methyl-1-(3-methyl-1,1-dioxothiolan-3-yl)-3-naphthalen-1-ylurea, 1-methyl-1-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-(naphthalen-1-yl)urea
| Molecular Formula | C17H20N2O3S |
|---|---|
| Molecular Weight | 332.12 g/mol |
| LogP | 2.8807 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 332.11948 |
| Heavy Atoms | 23 |
| Complexity | 857.77246 |
Chemical Identifiers
| CAS Number | 428451-60-9 |
|---|---|
| SMILES | CC1(CCS(=O)(=O)C1)N(C)C(=O)NC2=CC=CC3=CC=CC=C32 |
Product Overview
1-Methyl-1-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-naphthalen-1-ylurea (CAS 428451-60-9), with molecular formula C17H20N2O3S and molecular weight 332.12 g/mol. IUPAC: 1-methyl-1-(3-methyl-1,1-dioxothiolan-3-yl)-3-naphthalen-1-ylurea.
Chemical Property Profile of 1-Methyl-1-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-naphthalen-1-ylurea
Property Insights of 1-Methyl-1-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-naphthalen-1-ylurea
The XLogP value of 2.8807 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-1-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-naphthalen-1-ylurea. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Methyl-1-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-naphthalen-1-ylurea. Following Lipinski's Rule of Five, 1-Methyl-1-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-naphthalen-1-ylurea has 1 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-Methyl-1-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-naphthalen-1-ylurea?
The CAS number of 1-Methyl-1-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-naphthalen-1-ylurea is 428451-60-9.
What is the molecular formula of 1-Methyl-1-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-naphthalen-1-ylurea?
The molecular formula of 1-Methyl-1-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-naphthalen-1-ylurea is C17H20N2O3S.
What is the molecular weight of 1-Methyl-1-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-naphthalen-1-ylurea?
The molecular weight of 1-Methyl-1-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-naphthalen-1-ylurea is 332.12 g/mol.
Where can I buy 1-Methyl-1-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-naphthalen-1-ylurea?
You can request a quote for 1-Methyl-1-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-naphthalen-1-ylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-1-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-naphthalen-1-ylurea?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-1-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-naphthalen-1-ylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.