(4-bromophenyl){1-methyl-3-[4-methyl-5-(methylsulfanyl)-4H-1,2,4-triazol-3-yl]-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}methanone
Chemical Structure Depiction of
(4-bromophenyl){1-methyl-3-[4-methyl-5-(methylsulfanyl)-4H-1,2,4-triazol-3-yl]-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}methanone
(4-bromophenyl){1-methyl-3-[4-methyl-5-(methylsulfanyl)-4H-1,2,4-triazol-3-yl]-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}methanone
Compound characteristics
| Compound ID: | L886-0223 |
| Compound Name: | (4-bromophenyl){1-methyl-3-[4-methyl-5-(methylsulfanyl)-4H-1,2,4-triazol-3-yl]-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}methanone |
| Molecular Weight: | 447.35 |
| Molecular Formula: | C18 H19 Br N6 O S |
| Smiles: | Cn1c(c2c3CN(CCc3n(C)n2)C(c2ccc(cc2)[Br])=O)nnc1SC |
| Stereo: | ACHIRAL |
| logP: | 1.9603 |
| logD: | 1.9481 |
| logSw: | -2.3618 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.65 |
| InChI Key: | PIWOFVLTXQWVID-UHFFFAOYSA-N |