2,2-Dimethyl-5-phenyl-2,3-dihydro-1,3,4-thiadiazole
TL;DR: 2,2-Dimethyl-5-phenyl-2,3-dihydro-1,3,4-thiadiazole (CAS 76689-65-1) is a chemical compound with molecular formula C10H12N2S and molecular weight 192.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dimethyl-5-phenyl-3H-1,3,4-thiadiazole
Also Known As: 2,2-dimethyl-5-phenyl-3H-1,3,4-thiadiazole, 2,2-dimethyl-5-phenyl-1,3,4-thiadiazoline, 2,2-dimethyl-5-phenyl-1,3,4-thiazoline-2, 2,2-dimethyl-5-phenyl-2,3-dihydro-1,3,4-thiadiazole, 2,2-dimethyl-5-phenyl-2,3-dihydro-[1,3,4]thiadiazole
| Molecular Formula | C10H12N2S |
|---|---|
| Molecular Weight | 192.07 g/mol |
| LogP | 2.4207 |
| Topological Polar Surface Area | 24.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 192.07211 |
| Heavy Atoms | 13 |
| Complexity | 330.0378 |
Chemical Identifiers
| CAS Number | 76689-65-1 |
|---|---|
| SMILES | CC1(NN=C(S1)C2=CC=CC=C2)C |
Product Overview
2,2-Dimethyl-5-phenyl-2,3-dihydro-1,3,4-thiadiazole (CAS 76689-65-1), with molecular formula C10H12N2S and molecular weight 192.07 g/mol. IUPAC: 2,2-dimethyl-5-phenyl-3H-1,3,4-thiadiazole.
Chemical Property Profile of 2,2-Dimethyl-5-phenyl-2,3-dihydro-1,3,4-thiadiazole
Property Insights of 2,2-Dimethyl-5-phenyl-2,3-dihydro-1,3,4-thiadiazole
The XLogP value of 2.4207 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-Dimethyl-5-phenyl-2,3-dihydro-1,3,4-thiadiazole. With a topological polar surface area (TPSA) of 24.39 Ų, 2,2-Dimethyl-5-phenyl-2,3-dihydro-1,3,4-thiadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-Dimethyl-5-phenyl-2,3-dihydro-1,3,4-thiadiazole 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 2,2-Dimethyl-5-phenyl-2,3-dihydro-1,3,4-thiadiazole?
The CAS number of 2,2-Dimethyl-5-phenyl-2,3-dihydro-1,3,4-thiadiazole is 76689-65-1.
What is the molecular formula of 2,2-Dimethyl-5-phenyl-2,3-dihydro-1,3,4-thiadiazole?
The molecular formula of 2,2-Dimethyl-5-phenyl-2,3-dihydro-1,3,4-thiadiazole is C10H12N2S.
What is the molecular weight of 2,2-Dimethyl-5-phenyl-2,3-dihydro-1,3,4-thiadiazole?
The molecular weight of 2,2-Dimethyl-5-phenyl-2,3-dihydro-1,3,4-thiadiazole is 192.07 g/mol.
Where can I buy 2,2-Dimethyl-5-phenyl-2,3-dihydro-1,3,4-thiadiazole?
You can request a quote for 2,2-Dimethyl-5-phenyl-2,3-dihydro-1,3,4-thiadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-Dimethyl-5-phenyl-2,3-dihydro-1,3,4-thiadiazole?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Dimethyl-5-phenyl-2,3-dihydro-1,3,4-thiadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.