3,5-dimethyl-5-pyridin-2-yl-1,3,4-thiadiazolidine-2-thione
TL;DR: 3,5-dimethyl-5-pyridin-2-yl-1,3,4-thiadiazolidine-2-thione (CAS 74752-62-8) is a chemical compound with molecular formula C9H11N3S2 and molecular weight 225.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dimethyl-5-pyridin-2-yl-1,3,4-thiadiazolidine-2-thione
Also Known As: 3,5-dimethyl-5-pyridin-2-yl-1,3,4-thiadiazolidine-2-thione, 3,5-DIMETHYL-5-(PYRIDIN-2-YL)-1,3,4-THIADIAZOLIDINE-2-THIONE, 3,5-Dimethyl-5-[2-pyridyl]-1,3,4-thiadiazolidin-2-thione, 3,5-Dimethyl-5-(2-pyridinyl)-1,3,4-thiadiazolidine-2-thione #, RefChem:317451
| Molecular Formula | C9H11N3S2 |
|---|---|
| Molecular Weight | 225.04 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 85.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 225.03944 |
| Heavy Atoms | 14 |
| Complexity | 246.0 |
Chemical Identifiers
| CAS Number | 74752-62-8 |
|---|---|
| SMILES | CC1(NN(C(=S)S1)C)C2=CC=CC=N2 |
| InChIKey | CQDDNBVPSLQVJU-UHFFFAOYSA-N |
Product Overview
3,5-dimethyl-5-pyridin-2-yl-1,3,4-thiadiazolidine-2-thione (CAS 74752-62-8), with molecular formula C9H11N3S2 and molecular weight 225.04 g/mol. IUPAC: 3,5-dimethyl-5-pyridin-2-yl-1,3,4-thiadiazolidine-2-thione.
Chemical Property Profile of 3,5-dimethyl-5-pyridin-2-yl-1,3,4-thiadiazolidine-2-thione
Property Insights of 3,5-dimethyl-5-pyridin-2-yl-1,3,4-thiadiazolidine-2-thione
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-dimethyl-5-pyridin-2-yl-1,3,4-thiadiazolidine-2-thione. The TPSA of 85.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-dimethyl-5-pyridin-2-yl-1,3,4-thiadiazolidine-2-thione. Following Lipinski's Rule of Five, 3,5-dimethyl-5-pyridin-2-yl-1,3,4-thiadiazolidine-2-thione 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 3,5-dimethyl-5-pyridin-2-yl-1,3,4-thiadiazolidine-2-thione?
The CAS number of 3,5-dimethyl-5-pyridin-2-yl-1,3,4-thiadiazolidine-2-thione is 74752-62-8.
What is the molecular formula of 3,5-dimethyl-5-pyridin-2-yl-1,3,4-thiadiazolidine-2-thione?
The molecular formula of 3,5-dimethyl-5-pyridin-2-yl-1,3,4-thiadiazolidine-2-thione is C9H11N3S2.
What is the molecular weight of 3,5-dimethyl-5-pyridin-2-yl-1,3,4-thiadiazolidine-2-thione?
The molecular weight of 3,5-dimethyl-5-pyridin-2-yl-1,3,4-thiadiazolidine-2-thione is 225.04 g/mol.
Where can I buy 3,5-dimethyl-5-pyridin-2-yl-1,3,4-thiadiazolidine-2-thione?
You can request a quote for 3,5-dimethyl-5-pyridin-2-yl-1,3,4-thiadiazolidine-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-dimethyl-5-pyridin-2-yl-1,3,4-thiadiazolidine-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 3,5-dimethyl-5-pyridin-2-yl-1,3,4-thiadiazolidine-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.