1-[(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetyl]piperidine-4-carboxylic acid
Chemical Structure Depiction of
1-[(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetyl]piperidine-4-carboxylic acid
1-[(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetyl]piperidine-4-carboxylic acid
Compound characteristics
| Compound ID: | J102-0014 |
| Compound Name: | 1-[(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetyl]piperidine-4-carboxylic acid |
| Molecular Weight: | 333.39 |
| Molecular Formula: | C17 H23 N3 O4 |
| Smiles: | C1CCC2=CC(N(CC(N3CCC(CC3)C(O)=O)=O)N=C2CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.0686 |
| logD: | -2.4844 |
| logSw: | -0.4718 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.365 |
| InChI Key: | DNLXFWOEAXBTHA-UHFFFAOYSA-N |