7-[(diethylamino)methyl]-N-(2-methylpropyl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Chemical Structure Depiction of
7-[(diethylamino)methyl]-N-(2-methylpropyl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
7-[(diethylamino)methyl]-N-(2-methylpropyl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Compound characteristics
| Compound ID: | T634-0472 |
| Compound Name: | 7-[(diethylamino)methyl]-N-(2-methylpropyl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide |
| Molecular Weight: | 333.47 |
| Molecular Formula: | C19 H31 N3 O2 |
| Smiles: | CCN(CC)Cc1ccc2c(CN(CCO2)C(NCC(C)C)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.0065 |
| logD: | 1.2529 |
| logSw: | -3.1582 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.678 |
| InChI Key: | SVPJKCLHJFDGPL-UHFFFAOYSA-N |