N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-7-yl)piperazine-1-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-7-yl)piperazine-1-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-7-yl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | T473-0418 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-7-yl)piperazine-1-carboxamide |
| Molecular Weight: | 395.42 |
| Molecular Formula: | C19 H21 N7 O3 |
| Smiles: | Cc1nnc2cc(cnn12)N1CCN(CC1)C(Nc1ccc2c(c1)OCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | -0.0877 |
| logD: | -0.0878 |
| logSw: | -1.9484 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.222 |
| InChI Key: | ROCTXYAKRAXXMU-UHFFFAOYSA-N |