(2R)-[2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetamido](phenyl)acetic acid
Chemical Structure Depiction of
(2R)-[2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetamido](phenyl)acetic acid
(2R)-[2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetamido](phenyl)acetic acid
Compound characteristics
| Compound ID: | J102-0010 |
| Compound Name: | (2R)-[2-(3-oxo-3,5,6,7,8,9-hexahydro-2H-cyclohepta[c]pyridazin-2-yl)acetamido](phenyl)acetic acid |
| Molecular Weight: | 355.39 |
| Molecular Formula: | C19 H21 N3 O4 |
| Smiles: | C1CCC2=CC(N(CC(N[C@@H](C(O)=O)c3ccccc3)=O)N=C2CC1)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.0128 |
| logD: | -2.9036 |
| logSw: | -1.9407 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.796 |
| InChI Key: | RGEDXICQKLVASR-GOSISDBHSA-N |