(4-chlorophenyl){3-[4-ethyl-5-(methylsulfanyl)-4H-1,2,4-triazol-3-yl]-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}methanone
Chemical Structure Depiction of
(4-chlorophenyl){3-[4-ethyl-5-(methylsulfanyl)-4H-1,2,4-triazol-3-yl]-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}methanone
(4-chlorophenyl){3-[4-ethyl-5-(methylsulfanyl)-4H-1,2,4-triazol-3-yl]-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}methanone
Compound characteristics
| Compound ID: | L886-0348 |
| Compound Name: | (4-chlorophenyl){3-[4-ethyl-5-(methylsulfanyl)-4H-1,2,4-triazol-3-yl]-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}methanone |
| Molecular Weight: | 416.93 |
| Molecular Formula: | C19 H21 Cl N6 O S |
| Smiles: | CCn1c(c2c3CN(CCc3n(C)n2)C(c2ccc(cc2)[Cl])=O)nnc1SC |
| Stereo: | ACHIRAL |
| logP: | 2.3356 |
| logD: | 2.2974 |
| logSw: | -3.0818 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.565 |
| InChI Key: | KCQCKRJPXMTJEK-UHFFFAOYSA-N |