N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-3-methylbut-2-enamide
Chemical Structure Depiction of
N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-3-methylbut-2-enamide
N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-3-methylbut-2-enamide
Compound characteristics
| Compound ID: | V013-4580 |
| Compound Name: | N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-3-methylbut-2-enamide |
| Molecular Weight: | 249.28 |
| Molecular Formula: | C14 H16 F N O2 |
| Smiles: | CC(C)=CC(NCC1Cc2cc(ccc2O1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7577 |
| logD: | 2.7577 |
| logSw: | -3.0745 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.306 |
| InChI Key: | XOTJCIANDVLWLT-GFCCVEGCSA-N |