N-{4-[4-(methoxycarbonyl)phenyl]-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carbonyl}-beta-alanine
Chemical Structure Depiction of
N-{4-[4-(methoxycarbonyl)phenyl]-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carbonyl}-beta-alanine
N-{4-[4-(methoxycarbonyl)phenyl]-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carbonyl}-beta-alanine
Compound characteristics
| Compound ID: | 8017-2987 |
| Compound Name: | N-{4-[4-(methoxycarbonyl)phenyl]-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carbonyl}-beta-alanine |
| Molecular Weight: | 420.46 |
| Molecular Formula: | C24 H24 N2 O5 |
| Smiles: | COC(c1ccc(cc1)C1C2CC=CC2c2cc(ccc2N1)C(NCCC(O)=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.0432 |
| logD: | 0.3475 |
| logSw: | -3.4628 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 86.406 |
| InChI Key: | XFZYFNFEFFKRCP-UHFFFAOYSA-N |