N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[6-(5-bromothiophen-2-yl)pyridazin-3-yl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[6-(5-bromothiophen-2-yl)pyridazin-3-yl]piperidine-4-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[6-(5-bromothiophen-2-yl)pyridazin-3-yl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | G274-0950 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[6-(5-bromothiophen-2-yl)pyridazin-3-yl]piperidine-4-carboxamide |
| Molecular Weight: | 501.4 |
| Molecular Formula: | C22 H21 Br N4 O3 S |
| Smiles: | C1CN(CCC1C(NCc1ccc2c(c1)OCO2)=O)c1ccc(c2ccc(s2)[Br])nn1 |
| Stereo: | ACHIRAL |
| logP: | 4.0849 |
| logD: | 4.0848 |
| logSw: | -4.2239 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.173 |
| InChI Key: | AXWUUVTTXAEINH-UHFFFAOYSA-N |