![3-{[(2-Pyridylamino)thioxomethyl]amino}thiolane-1,1-dione structure](/static/products/4436/443652-52-6.webp)
3-{[(2-Pyridylamino)thioxomethyl]amino}thiolane-1,1-dione
TL;DR: 3-{[(2-Pyridylamino)thioxomethyl]amino}thiolane-1,1-dione (CAS 443652-52-6) is a chemical compound with molecular formula C10H13N3O2S2 and molecular weight 271.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,1-dioxothiolan-3-yl)-3-pyridin-2-ylthiourea
Also Known As: SDCCGMLS-0065180.P001, 3-{[(2-pyridylamino)thioxomethyl]amino}thiolane-1,1-dione, 1-(1,1-dioxothiolan-3-yl)-3-pyridin-2-ylthiourea, 1-(1,1-dioxidotetrahydrothiophen-3-yl)-3-pyridin-2-ylthiourea, 1-(1,1-dioxidotetrahydrothiophen-3-yl)-3-(pyridin-2-yl)thiourea
| Molecular Formula | C10H13N3O2S2 |
|---|---|
| Molecular Weight | 271.04 g/mol |
| LogP | 0.5551 |
| Topological Polar Surface Area | 71.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 271.04492 |
| Heavy Atoms | 17 |
| Complexity | 501.5421 |
Chemical Identifiers
| CAS Number | 443652-52-6 |
|---|---|
| SMILES | C1CS(=O)(=O)CC1NC(=S)NC2=CC=CC=N2 |
Product Overview
3-{[(2-Pyridylamino)thioxomethyl]amino}thiolane-1,1-dione (CAS 443652-52-6), with molecular formula C10H13N3O2S2 and molecular weight 271.04 g/mol. IUPAC: 1-(1,1-dioxothiolan-3-yl)-3-pyridin-2-ylthiourea.
Chemical Property Profile of 3-{[(2-Pyridylamino)thioxomethyl]amino}thiolane-1,1-dione
Property Insights of 3-{[(2-Pyridylamino)thioxomethyl]amino}thiolane-1,1-dione
The XLogP value of 0.5551 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-{[(2-Pyridylamino)thioxomethyl]amino}thiolane-1,1-dione. The TPSA of 71.09 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{[(2-Pyridylamino)thioxomethyl]amino}thiolane-1,1-dione. Following Lipinski's Rule of Five, 3-{[(2-Pyridylamino)thioxomethyl]amino}thiolane-1,1-dione 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 3-{[(2-Pyridylamino)thioxomethyl]amino}thiolane-1,1-dione?
The CAS number of 3-{[(2-Pyridylamino)thioxomethyl]amino}thiolane-1,1-dione is 443652-52-6.
What is the molecular formula of 3-{[(2-Pyridylamino)thioxomethyl]amino}thiolane-1,1-dione?
The molecular formula of 3-{[(2-Pyridylamino)thioxomethyl]amino}thiolane-1,1-dione is C10H13N3O2S2.
What is the molecular weight of 3-{[(2-Pyridylamino)thioxomethyl]amino}thiolane-1,1-dione?
The molecular weight of 3-{[(2-Pyridylamino)thioxomethyl]amino}thiolane-1,1-dione is 271.04 g/mol.
Where can I buy 3-{[(2-Pyridylamino)thioxomethyl]amino}thiolane-1,1-dione?
You can request a quote for 3-{[(2-Pyridylamino)thioxomethyl]amino}thiolane-1,1-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-{[(2-Pyridylamino)thioxomethyl]amino}thiolane-1,1-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-{[(2-Pyridylamino)thioxomethyl]amino}thiolane-1,1-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.