N-(cyclopropylmethyl)-3-[4-(3-fluoro-4-methoxybenzoyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide
Chemical Structure Depiction of
N-(cyclopropylmethyl)-3-[4-(3-fluoro-4-methoxybenzoyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide
N-(cyclopropylmethyl)-3-[4-(3-fluoro-4-methoxybenzoyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide
Compound characteristics
| Compound ID: | S629-1980 |
| Compound Name: | N-(cyclopropylmethyl)-3-[4-(3-fluoro-4-methoxybenzoyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide |
| Molecular Weight: | 426.49 |
| Molecular Formula: | C24 H27 F N2 O4 |
| Smiles: | COc1ccc(cc1F)C(N1CCOc2ccc(CCC(NCC3CC3)=O)cc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9953 |
| logD: | 2.9953 |
| logSw: | -3.3535 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.184 |
| InChI Key: | NRTAHOKGFOPZMF-UHFFFAOYSA-N |