N-[4-(2H-1,3-benzodioxol-5-yl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carbonyl]-beta-alanine
Chemical Structure Depiction of
N-[4-(2H-1,3-benzodioxol-5-yl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carbonyl]-beta-alanine
N-[4-(2H-1,3-benzodioxol-5-yl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carbonyl]-beta-alanine
Compound characteristics
| Compound ID: | 8017-2989 |
| Compound Name: | N-[4-(2H-1,3-benzodioxol-5-yl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carbonyl]-beta-alanine |
| Molecular Weight: | 406.44 |
| Molecular Formula: | C23 H22 N2 O5 |
| Smiles: | C1C=CC2C1C(c1ccc3c(c1)OCO3)Nc1ccc(cc12)C(NCCC(O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.8828 |
| logD: | 0.1871 |
| logSw: | -3.501 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 82.347 |
| InChI Key: | FKCUFGDZFCIEGA-UHFFFAOYSA-N |