N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)propyl]-3-(2-fluorophenyl)prop-2-enamide
Chemical Structure Depiction of
N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)propyl]-3-(2-fluorophenyl)prop-2-enamide
N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)propyl]-3-(2-fluorophenyl)prop-2-enamide
Compound characteristics
| Compound ID: | J031-1012 |
| Compound Name: | N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)propyl]-3-(2-fluorophenyl)prop-2-enamide |
| Molecular Weight: | 355.41 |
| Molecular Formula: | C21 H22 F N O3 |
| Smiles: | CCC(c1ccc2c(c1)OCCCO2)NC(/C=C/c1ccccc1F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8247 |
| logD: | 3.8247 |
| logSw: | -3.8781 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.223 |
| InChI Key: | ALGYCKCDEMYFBE-SFHVURJKSA-N |