4-[(2,3-dihydro-1-benzofuran-5-yl)methyl]-N-[(2-fluorophenyl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide
Chemical Structure Depiction of
4-[(2,3-dihydro-1-benzofuran-5-yl)methyl]-N-[(2-fluorophenyl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide
4-[(2,3-dihydro-1-benzofuran-5-yl)methyl]-N-[(2-fluorophenyl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide
Compound characteristics
| Compound ID: | M400-0181 |
| Compound Name: | 4-[(2,3-dihydro-1-benzofuran-5-yl)methyl]-N-[(2-fluorophenyl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide |
| Molecular Weight: | 432.49 |
| Molecular Formula: | C26 H25 F N2 O3 |
| Smiles: | C1COc2ccc(CN3CCOc4ccc(cc4C3)C(NCc3ccccc3F)=O)cc12 |
| Stereo: | ACHIRAL |
| logP: | 4.357 |
| logD: | 3.9366 |
| logSw: | -4.3673 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.566 |
| InChI Key: | QYBUAPYNXVVFAE-UHFFFAOYSA-N |