N-cyclopropyl-3-[4-(3-fluoro-4-methoxybenzoyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide
Chemical Structure Depiction of
N-cyclopropyl-3-[4-(3-fluoro-4-methoxybenzoyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide
N-cyclopropyl-3-[4-(3-fluoro-4-methoxybenzoyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide
Compound characteristics
| Compound ID: | S629-1659 |
| Compound Name: | N-cyclopropyl-3-[4-(3-fluoro-4-methoxybenzoyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide |
| Molecular Weight: | 412.46 |
| Molecular Formula: | C23 H25 F N2 O4 |
| Smiles: | COc1ccc(cc1F)C(N1CCOc2ccc(CCC(NC3CC3)=O)cc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7754 |
| logD: | 2.7754 |
| logSw: | -3.2182 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.718 |
| InChI Key: | VRMYMTCWQFSOHD-UHFFFAOYSA-N |