{3-[5-(ethylsulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}(3-methoxyphenyl)methanone
Chemical Structure Depiction of
{3-[5-(ethylsulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}(3-methoxyphenyl)methanone
{3-[5-(ethylsulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}(3-methoxyphenyl)methanone
Compound characteristics
| Compound ID: | L886-0002 |
| Compound Name: | {3-[5-(ethylsulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}(3-methoxyphenyl)methanone |
| Molecular Weight: | 412.51 |
| Molecular Formula: | C20 H24 N6 O2 S |
| Smiles: | CCSc1nnc(c2c3CN(CCc3n(C)n2)C(c2cccc(c2)OC)=O)n1C |
| Stereo: | ACHIRAL |
| logP: | 1.5047 |
| logD: | 1.4805 |
| logSw: | -2.3248 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.194 |
| InChI Key: | CNVSOYAFHCTTKU-UHFFFAOYSA-N |