1-{6-[(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)sulfanyl]pyridazin-3-yl}-N-propylpiperidine-4-carboxamide
Chemical Structure Depiction of
1-{6-[(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)sulfanyl]pyridazin-3-yl}-N-propylpiperidine-4-carboxamide
1-{6-[(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)sulfanyl]pyridazin-3-yl}-N-propylpiperidine-4-carboxamide
Compound characteristics
| Compound ID: | L381-1314 |
| Compound Name: | 1-{6-[(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)sulfanyl]pyridazin-3-yl}-N-propylpiperidine-4-carboxamide |
| Molecular Weight: | 471.58 |
| Molecular Formula: | C23 H29 N5 O4 S |
| Smiles: | CCCNC(C1CCN(CC1)c1ccc(nn1)SCC(NCc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4351 |
| logD: | 2.435 |
| logSw: | -2.879 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.1 |
| InChI Key: | WAUKTOVYEWGDJK-UHFFFAOYSA-N |