3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Chemical Structure Depiction of
3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Compound characteristics
| Compound ID: | J031-0421 |
| Compound Name: | 3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide |
| Molecular Weight: | 193.2 |
| Molecular Formula: | C10 H11 N O3 |
| Smiles: | C1COc2ccc(cc2OC1)C(N)=O |
| Stereo: | ACHIRAL |
| logP: | 0.3611 |
| logD: | 0.3611 |
| logSw: | -1.4863 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.451 |
| InChI Key: | ISEQFVBXCPUJGM-UHFFFAOYSA-N |