(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetic acid
Chemical Structure Depiction of
(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetic acid
(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetic acid
Compound characteristics
| Compound ID: | Y041-0764 |
| Compound Name: | (3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetic acid |
| Molecular Weight: | 222.24 |
| Molecular Formula: | C11 H14 N2 O3 |
| Smiles: | C1CCC2=CC(N(CC(O)=O)N=C2CC1)=O |
| Stereo: | ACHIRAL |
| logP: | -0.0682 |
| logD: | -3.7994 |
| logSw: | -0.2567 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.219 |
| InChI Key: | PBSUVJYSLPPULE-UHFFFAOYSA-N |