N-(4-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}phenyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
Chemical Structure Depiction of
N-(4-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}phenyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
N-(4-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}phenyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
Compound characteristics
| Compound ID: | G217-1238 |
| Compound Name: | N-(4-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}phenyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide |
| Molecular Weight: | 486.59 |
| Molecular Formula: | C29 H31 F N4 O2 |
| Smiles: | C1CCN(C(Nc2ccc(CC(N3CCN(CC3)c3ccccc3F)=O)cc2)=O)c2ccccc2C1 |
| Stereo: | ACHIRAL |
| logP: | 5.3708 |
| logD: | 5.3708 |
| logSw: | -5.5569 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.783 |
| InChI Key: | HQHREQQAQZLAAC-UHFFFAOYSA-N |