N-(cyclopropylmethyl)-3-(4-propanoyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)propanamide
Chemical Structure Depiction of
N-(cyclopropylmethyl)-3-(4-propanoyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)propanamide
N-(cyclopropylmethyl)-3-(4-propanoyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)propanamide
Compound characteristics
| Compound ID: | S629-2041 |
| Compound Name: | N-(cyclopropylmethyl)-3-(4-propanoyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)propanamide |
| Molecular Weight: | 330.43 |
| Molecular Formula: | C19 H26 N2 O3 |
| Smiles: | CCC(N1CCOc2ccc(CCC(NCC3CC3)=O)cc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2691 |
| logD: | 2.2691 |
| logSw: | -2.801 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.298 |
| InChI Key: | SCSOKMNWFRNJPJ-UHFFFAOYSA-N |