![3-{[(1,3-Thiazol-2-ylamino)thioxomethyl]amino}thiolane-1,1-dione structure](/static/products/4436/443652-16-2.webp)
3-{[(1,3-Thiazol-2-ylamino)thioxomethyl]amino}thiolane-1,1-dione
TL;DR: 3-{[(1,3-Thiazol-2-ylamino)thioxomethyl]amino}thiolane-1,1-dione (CAS 443652-16-2) is a chemical compound with molecular formula C8H11N3O2S3 and molecular weight 277.00 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-(1,3-thiazol-2-yl)thiourea
Also Known As: 3-{[(1,3-thiazol-2-ylamino)thioxomethyl]amino}thiolane-1,1-dione, 1-(1,1-dioxothiolan-3-yl)-3-(1,3-thiazol-2-yl)thiourea, 3-(1,1-dioxo-1??-thiolan-3-yl)-1-(1,3-thiazol-2-yl)thiourea
| Molecular Formula | C8H11N3O2S3 |
|---|---|
| Molecular Weight | 277.00 g/mol |
| LogP | 0.6166 |
| Topological Polar Surface Area | 71.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 277.00134 |
| Heavy Atoms | 16 |
| Complexity | 468.72778 |
Chemical Identifiers
| CAS Number | 443652-16-2 |
|---|---|
| SMILES | C1CS(=O)(=O)CC1NC(=S)NC2=NC=CS2 |
Product Overview
3-{[(1,3-Thiazol-2-ylamino)thioxomethyl]amino}thiolane-1,1-dione (CAS 443652-16-2), with molecular formula C8H11N3O2S3 and molecular weight 277.00 g/mol. IUPAC: 1-(1,1-dioxothiolan-3-yl)-3-(1,3-thiazol-2-yl)thiourea.
Chemical Property Profile of 3-{[(1,3-Thiazol-2-ylamino)thioxomethyl]amino}thiolane-1,1-dione
Property Insights of 3-{[(1,3-Thiazol-2-ylamino)thioxomethyl]amino}thiolane-1,1-dione
The XLogP value of 0.6166 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-{[(1,3-Thiazol-2-ylamino)thioxomethyl]amino}thiolane-1,1-dione. The TPSA of 71.09 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{[(1,3-Thiazol-2-ylamino)thioxomethyl]amino}thiolane-1,1-dione. Following Lipinski's Rule of Five, 3-{[(1,3-Thiazol-2-ylamino)thioxomethyl]amino}thiolane-1,1-dione has 2 hydrogen bond donor(s) and 5 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-{[(1,3-Thiazol-2-ylamino)thioxomethyl]amino}thiolane-1,1-dione?
The CAS number of 3-{[(1,3-Thiazol-2-ylamino)thioxomethyl]amino}thiolane-1,1-dione is 443652-16-2.
What is the molecular formula of 3-{[(1,3-Thiazol-2-ylamino)thioxomethyl]amino}thiolane-1,1-dione?
The molecular formula of 3-{[(1,3-Thiazol-2-ylamino)thioxomethyl]amino}thiolane-1,1-dione is C8H11N3O2S3.
What is the molecular weight of 3-{[(1,3-Thiazol-2-ylamino)thioxomethyl]amino}thiolane-1,1-dione?
The molecular weight of 3-{[(1,3-Thiazol-2-ylamino)thioxomethyl]amino}thiolane-1,1-dione is 277.00 g/mol.
Where can I buy 3-{[(1,3-Thiazol-2-ylamino)thioxomethyl]amino}thiolane-1,1-dione?
You can request a quote for 3-{[(1,3-Thiazol-2-ylamino)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-{[(1,3-Thiazol-2-ylamino)thioxomethyl]amino}thiolane-1,1-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-{[(1,3-Thiazol-2-ylamino)thioxomethyl]amino}thiolane-1,1-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.