6-(3,5-dichlorophenyl)-5,6,6a,7,8,9,10,10a-octahydro-7,10-methanophenanthridine-4-carboxylic acid
Chemical Structure Depiction of
6-(3,5-dichlorophenyl)-5,6,6a,7,8,9,10,10a-octahydro-7,10-methanophenanthridine-4-carboxylic acid
6-(3,5-dichlorophenyl)-5,6,6a,7,8,9,10,10a-octahydro-7,10-methanophenanthridine-4-carboxylic acid
Compound characteristics
| Compound ID: | 8017-2790 |
| Compound Name: | 6-(3,5-dichlorophenyl)-5,6,6a,7,8,9,10,10a-octahydro-7,10-methanophenanthridine-4-carboxylic acid |
| Molecular Weight: | 388.29 |
| Molecular Formula: | C21 H19 Cl2 N O2 |
| Smiles: | C1CC2CC1C1C2c2cccc(C(O)=O)c2NC1c1cc(cc(c1)[Cl])[Cl] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.4152 |
| logD: | 2.9476 |
| logSw: | -5.7451 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 38.764 |
| InChI Key: | INPSTTSVKOBIOZ-UHFFFAOYSA-N |