N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-fluorophenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-fluorophenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-fluorophenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide
Compound characteristics
| Compound ID: | E598-0561 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-fluorophenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide |
| Molecular Weight: | 437.51 |
| Molecular Formula: | C25 H28 F N3 O3 |
| Smiles: | COc1ccc(CCNC(c2c3CCCCCn3c(c3cccc(c3)F)n2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.1425 |
| logD: | 4.1425 |
| logSw: | -4.1682 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.595 |
| InChI Key: | WRIMRYSSJNNUNZ-UHFFFAOYSA-N |