1-(3-Methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-(pyridin-2-yl)thiourea
TL;DR: 1-(3-Methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-(pyridin-2-yl)thiourea (CAS 443653-03-0) is a chemical compound with molecular formula C11H15N3O2S2 and molecular weight 285.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-methyl-1,1-dioxothiolan-3-yl)-3-pyridin-2-ylthiourea
Also Known As: 1-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-(pyridin-2-yl)thiourea, 1-(3-methyl-1,1-dioxothiolan-3-yl)-3-pyridin-2-ylthiourea, 1-(3-methyl-1,1-dioxo-thiolan-3-yl)-3-pyridin-2-yl-thiourea, 3-(3-methyl-1,1-dioxo-1lambda6-thiolan-3-yl)-1-(pyridin-2-yl)thiourea, 3-methyl-3-{[(2-pyridylamino)thioxomethyl]amino}thiolane-1,1-dione
| Molecular Formula | C11H15N3O2S2 |
|---|---|
| Molecular Weight | 285.06 g/mol |
| LogP | 0.9452 |
| Topological Polar Surface Area | 71.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 285.06058 |
| Heavy Atoms | 18 |
| Complexity | 544.66656 |
Chemical Identifiers
| CAS Number | 443653-03-0 |
|---|---|
| SMILES | CC1(CCS(=O)(=O)C1)NC(=S)NC2=CC=CC=N2 |
Product Overview
1-(3-Methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-(pyridin-2-yl)thiourea (CAS 443653-03-0), with molecular formula C11H15N3O2S2 and molecular weight 285.06 g/mol. IUPAC: 1-(3-methyl-1,1-dioxothiolan-3-yl)-3-pyridin-2-ylthiourea.
Chemical Property Profile of 1-(3-Methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-(pyridin-2-yl)thiourea
Property Insights of 1-(3-Methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-(pyridin-2-yl)thiourea
The XLogP value of 0.9452 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-(pyridin-2-yl)thiourea. The TPSA of 71.09 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-Methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-(pyridin-2-yl)thiourea. Following Lipinski's Rule of Five, 1-(3-Methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-(pyridin-2-yl)thiourea 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-(3-Methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-(pyridin-2-yl)thiourea?
The CAS number of 1-(3-Methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-(pyridin-2-yl)thiourea is 443653-03-0.
What is the molecular formula of 1-(3-Methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-(pyridin-2-yl)thiourea?
The molecular formula of 1-(3-Methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-(pyridin-2-yl)thiourea is C11H15N3O2S2.
What is the molecular weight of 1-(3-Methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-(pyridin-2-yl)thiourea?
The molecular weight of 1-(3-Methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-(pyridin-2-yl)thiourea is 285.06 g/mol.
Where can I buy 1-(3-Methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-(pyridin-2-yl)thiourea?
You can request a quote for 1-(3-Methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-(pyridin-2-yl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-(pyridin-2-yl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Methyl-1,1-dioxidotetrahydrothiophen-3-yl)-3-(pyridin-2-yl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.