3-[4-ethyl-5-(ethylsulfanyl)-4H-1,2,4-triazol-3-yl]-5-(3-methoxybenzene-1-sulfonyl)-1-methyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
Chemical Structure Depiction of
3-[4-ethyl-5-(ethylsulfanyl)-4H-1,2,4-triazol-3-yl]-5-(3-methoxybenzene-1-sulfonyl)-1-methyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
3-[4-ethyl-5-(ethylsulfanyl)-4H-1,2,4-triazol-3-yl]-5-(3-methoxybenzene-1-sulfonyl)-1-methyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
Compound characteristics
| Compound ID: | L888-0385 |
| Compound Name: | 3-[4-ethyl-5-(ethylsulfanyl)-4H-1,2,4-triazol-3-yl]-5-(3-methoxybenzene-1-sulfonyl)-1-methyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine |
| Molecular Weight: | 462.59 |
| Molecular Formula: | C20 H26 N6 O3 S2 |
| Smiles: | CCn1c(c2c3CN(CCc3n(C)n2)S(c2cccc(c2)OC)(=O)=O)nnc1SCC |
| Stereo: | ACHIRAL |
| logP: | 2.5327 |
| logD: | 2.5053 |
| logSw: | -2.6985 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 78.171 |
| InChI Key: | DTPJAFZUVIDFHD-UHFFFAOYSA-N |