N-[(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetyl]-L-phenylalanine
Chemical Structure Depiction of
N-[(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetyl]-L-phenylalanine
N-[(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetyl]-L-phenylalanine
Compound characteristics
| Compound ID: | Y043-1548 |
| Compound Name: | N-[(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetyl]-L-phenylalanine |
| Molecular Weight: | 369.42 |
| Molecular Formula: | C20 H23 N3 O4 |
| Smiles: | C1CCC2=CC(N(CC(N[C@@H](Cc3ccccc3)C(O)=O)=O)N=C2CC1)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.9352 |
| logD: | -2.6975 |
| logSw: | -1.8256 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.074 |
| InChI Key: | XXNWYOHPHXHNNM-KRWDZBQOSA-N |