1-[6-({2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}sulfanyl)pyridazin-3-yl]-N-(propan-2-yl)piperidine-4-carboxamide
Chemical Structure Depiction of
1-[6-({2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}sulfanyl)pyridazin-3-yl]-N-(propan-2-yl)piperidine-4-carboxamide
1-[6-({2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}sulfanyl)pyridazin-3-yl]-N-(propan-2-yl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | L381-0882 |
| Compound Name: | 1-[6-({2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}sulfanyl)pyridazin-3-yl]-N-(propan-2-yl)piperidine-4-carboxamide |
| Molecular Weight: | 457.55 |
| Molecular Formula: | C22 H27 N5 O4 S |
| Smiles: | CC(C)NC(C1CCN(CC1)c1ccc(nn1)SCC(Nc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5619 |
| logD: | 2.5618 |
| logSw: | -3.0461 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.911 |
| InChI Key: | AXLNICXJPMBGAR-UHFFFAOYSA-N |