1-methyl-5-(3-methylbenzene-1-sulfonyl)-3-[4-methyl-5-(methylsulfanyl)-4H-1,2,4-triazol-3-yl]-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
Chemical Structure Depiction of
1-methyl-5-(3-methylbenzene-1-sulfonyl)-3-[4-methyl-5-(methylsulfanyl)-4H-1,2,4-triazol-3-yl]-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
1-methyl-5-(3-methylbenzene-1-sulfonyl)-3-[4-methyl-5-(methylsulfanyl)-4H-1,2,4-triazol-3-yl]-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
Compound characteristics
| Compound ID: | L888-0202 |
| Compound Name: | 1-methyl-5-(3-methylbenzene-1-sulfonyl)-3-[4-methyl-5-(methylsulfanyl)-4H-1,2,4-triazol-3-yl]-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine |
| Molecular Weight: | 418.54 |
| Molecular Formula: | C18 H22 N6 O2 S2 |
| Smiles: | Cc1cccc(c1)S(N1CCc2c(C1)c(c1nnc(n1C)SC)nn2C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9631 |
| logD: | 1.9588 |
| logSw: | -2.5545 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.713 |
| InChI Key: | ZWAGWVXBMGOUQP-UHFFFAOYSA-N |