[3-(dimethylamino)phenyl]{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
[3-(dimethylamino)phenyl]{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
[3-(dimethylamino)phenyl]{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: | L886-0176 |
| Compound Name: | [3-(dimethylamino)phenyl]{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: | 411.53 |
| Molecular Formula: | C20 H25 N7 O S |
| Smiles: | CN(C)c1cccc(c1)C(N1CCc2c(C1)c(c1nnc(n1C)SC)nn2C)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3599 |
| logD: | 1.3478 |
| logSw: | -2.3309 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 59.455 |
| InChI Key: | DWMQVPGAEAOMHA-UHFFFAOYSA-N |