3-{4-[(benzyloxy)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-N-(cyclopropylmethyl)propanamide
Chemical Structure Depiction of
3-{4-[(benzyloxy)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-N-(cyclopropylmethyl)propanamide
3-{4-[(benzyloxy)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-N-(cyclopropylmethyl)propanamide
Compound characteristics
| Compound ID: | S629-2082 |
| Compound Name: | 3-{4-[(benzyloxy)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-N-(cyclopropylmethyl)propanamide |
| Molecular Weight: | 422.52 |
| Molecular Formula: | C25 H30 N2 O4 |
| Smiles: | C(Cc1ccc2c(CN(CCO2)C(COCc2ccccc2)=O)c1)C(NCC1CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8856 |
| logD: | 2.8856 |
| logSw: | -3.2845 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.461 |
| InChI Key: | AXNFWNRDVTWKSI-UHFFFAOYSA-N |