N-[1-(1H-indole-2-carbonyl)piperidin-4-yl]-2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetamide
Chemical Structure Depiction of
N-[1-(1H-indole-2-carbonyl)piperidin-4-yl]-2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetamide
N-[1-(1H-indole-2-carbonyl)piperidin-4-yl]-2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetamide
Compound characteristics
| Compound ID: | J102-0278 |
| Compound Name: | N-[1-(1H-indole-2-carbonyl)piperidin-4-yl]-2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetamide |
| Molecular Weight: | 447.54 |
| Molecular Formula: | C25 H29 N5 O3 |
| Smiles: | C1CCC2=CC(N(CC(NC3CCN(CC3)C(c3cc4ccccc4[nH]3)=O)=O)N=C2CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7266 |
| logD: | 2.7266 |
| logSw: | -3.3159 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.566 |
| InChI Key: | JGTVKPWQMPHQKI-UHFFFAOYSA-N |