(3-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
(3-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
(3-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: | L886-0364 |
| Compound Name: | (3-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(c2cccc(c2)[Cl])=O)nnc1SC |
| Stereo: | ACHIRAL |
| logP: | 2.3196 |
| logD: | 2.2814 |
| logSw: | -3.2044 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.565 |
| InChI Key: | PXBXHRMDUVAZPT-UHFFFAOYSA-N |