N-[2,6-bis(trifluoromethyl)phenyl]-3-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)propanamide
Chemical Structure Depiction of
N-[2,6-bis(trifluoromethyl)phenyl]-3-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)propanamide
N-[2,6-bis(trifluoromethyl)phenyl]-3-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)propanamide
Compound characteristics
| Compound ID: | K906-0269 |
| Compound Name: | N-[2,6-bis(trifluoromethyl)phenyl]-3-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)propanamide |
| Molecular Weight: | 446.35 |
| Molecular Formula: | C20 H16 F6 N2 O3 |
| Smiles: | C(CN1C(C2C3CC(C=C3)C2C1=O)=O)C(Nc1c(cccc1C(F)(F)F)C(F)(F)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.6186 |
| logD: | 2.6186 |
| logSw: | -3.2831 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.068 |
| InChI Key: | BVWLQCVYAHHOLR-UHFFFAOYSA-N |