N-(cyclopropylmethyl)-3-{4-[(3-fluorophenyl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}propanamide
Chemical Structure Depiction of
N-(cyclopropylmethyl)-3-{4-[(3-fluorophenyl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}propanamide
N-(cyclopropylmethyl)-3-{4-[(3-fluorophenyl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}propanamide
Compound characteristics
| Compound ID: | S629-1975 |
| Compound Name: | N-(cyclopropylmethyl)-3-{4-[(3-fluorophenyl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}propanamide |
| Molecular Weight: | 410.49 |
| Molecular Formula: | C24 H27 F N2 O3 |
| Smiles: | C(Cc1ccc2c(CN(CCO2)C(Cc2cccc(c2)F)=O)c1)C(NCC1CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5041 |
| logD: | 3.5041 |
| logSw: | -3.5774 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.027 |
| InChI Key: | VCCPLGWCJVZFIN-UHFFFAOYSA-N |