N-(3-chlorophenyl)-3-(3-fluorophenyl)-N-methyl-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-3-(3-fluorophenyl)-N-methyl-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide
N-(3-chlorophenyl)-3-(3-fluorophenyl)-N-methyl-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide
Compound characteristics
| Compound ID: | E598-0622 |
| Compound Name: | N-(3-chlorophenyl)-3-(3-fluorophenyl)-N-methyl-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide |
| Molecular Weight: | 397.88 |
| Molecular Formula: | C22 H21 Cl F N3 O |
| Smiles: | CN(C(c1c2CCCCCn2c(c2cccc(c2)F)n1)=O)c1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.5317 |
| logD: | 5.5317 |
| logSw: | -5.8253 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 26.4481 |
| InChI Key: | BCOIJQOKCHFOEM-UHFFFAOYSA-N |