N-[(4-phenyloxan-4-yl)methyl]-2,3-dihydro-1,4-benzodioxine-2-carboxamide
Chemical Structure Depiction of
N-[(4-phenyloxan-4-yl)methyl]-2,3-dihydro-1,4-benzodioxine-2-carboxamide
N-[(4-phenyloxan-4-yl)methyl]-2,3-dihydro-1,4-benzodioxine-2-carboxamide
Compound characteristics
| Compound ID: | 4146-0546 |
| Compound Name: | N-[(4-phenyloxan-4-yl)methyl]-2,3-dihydro-1,4-benzodioxine-2-carboxamide |
| Molecular Weight: | 353.42 |
| Molecular Formula: | C21 H23 N O4 |
| Smiles: | C1COCCC1(CNC(C1COc2ccccc2O1)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2174 |
| logD: | 3.2174 |
| logSw: | -3.2642 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.918 |
| InChI Key: | JKDKXNBFRMMDQB-IBGZPJMESA-N |