6-methoxy-N-(2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)-3,4-dihydro-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
6-methoxy-N-(2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)-3,4-dihydro-2H-1-benzopyran-3-carboxamide
6-methoxy-N-(2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)-3,4-dihydro-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | G668-0653 |
| Compound Name: | 6-methoxy-N-(2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)-3,4-dihydro-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 463.5 |
| Molecular Formula: | C24 H28 F3 N3 O3 |
| Smiles: | COc1ccc2c(CC(CO2)C(NCCN2CCN(CC2)c2cccc(c2)C(F)(F)F)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7318 |
| logD: | 3.5852 |
| logSw: | -3.9665 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.65 |
| InChI Key: | WDTJDGJWWRSVMF-SFHVURJKSA-N |