3-(5-Methyl-1,3,4-thiadiazol-2-yl)propanenitrile
TL;DR: 3-(5-Methyl-1,3,4-thiadiazol-2-yl)propanenitrile (CAS 65133-02-0) is a chemical compound with molecular formula C6H7N3S and molecular weight 153.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(5-methyl-1,3,4-thiadiazol-2-yl)propanenitrile
Also Known As: Acetylenic Cypermethrin, 3-(5-methyl-1,3,4-thiadiazol-2-yl)propanenitrile, 1,3,4-Thiadiazole-2-propanenitrile, 5-methyl-, 1,3,4-Thiadiazole-2-propanenitrile,5-methyl-
| Molecular Formula | C6H7N3S |
|---|---|
| Molecular Weight | 153.04 g/mol |
| LogP | 1.3027 |
| Topological Polar Surface Area | 49.57 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 153.03607 |
| Heavy Atoms | 10 |
| Complexity | 247.74077 |
Chemical Identifiers
| CAS Number | 65133-02-0 |
|---|---|
| SMILES | CC1=NN=C(S1)CCC#N |
Product Overview
3-(5-Methyl-1,3,4-thiadiazol-2-yl)propanenitrile (CAS 65133-02-0), with molecular formula C6H7N3S and molecular weight 153.04 g/mol. IUPAC: 3-(5-methyl-1,3,4-thiadiazol-2-yl)propanenitrile.
Chemical Property Profile of 3-(5-Methyl-1,3,4-thiadiazol-2-yl)propanenitrile
Property Insights of 3-(5-Methyl-1,3,4-thiadiazol-2-yl)propanenitrile
The XLogP value of 1.3027 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(5-Methyl-1,3,4-thiadiazol-2-yl)propanenitrile. With a topological polar surface area (TPSA) of 49.57 Ų, 3-(5-Methyl-1,3,4-thiadiazol-2-yl)propanenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(5-Methyl-1,3,4-thiadiazol-2-yl)propanenitrile has 0 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-Methyl-1,3,4-thiadiazol-2-yl)propanenitrile?
The CAS number of 3-(5-Methyl-1,3,4-thiadiazol-2-yl)propanenitrile is 65133-02-0.
What is the molecular formula of 3-(5-Methyl-1,3,4-thiadiazol-2-yl)propanenitrile?
The molecular formula of 3-(5-Methyl-1,3,4-thiadiazol-2-yl)propanenitrile is C6H7N3S.
What is the molecular weight of 3-(5-Methyl-1,3,4-thiadiazol-2-yl)propanenitrile?
The molecular weight of 3-(5-Methyl-1,3,4-thiadiazol-2-yl)propanenitrile is 153.04 g/mol.
Where can I buy 3-(5-Methyl-1,3,4-thiadiazol-2-yl)propanenitrile?
You can request a quote for 3-(5-Methyl-1,3,4-thiadiazol-2-yl)propanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(5-Methyl-1,3,4-thiadiazol-2-yl)propanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-(5-Methyl-1,3,4-thiadiazol-2-yl)propanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.