N-(5-chloro-2,4-dimethoxyphenyl)-3-(3-fluorophenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-3-(3-fluorophenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide
N-(5-chloro-2,4-dimethoxyphenyl)-3-(3-fluorophenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide
Compound characteristics
| Compound ID: | E598-0523 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-3-(3-fluorophenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide |
| Molecular Weight: | 443.9 |
| Molecular Formula: | C23 H23 Cl F N3 O3 |
| Smiles: | COc1cc(c(cc1NC(c1c2CCCCCn2c(c2cccc(c2)F)n1)=O)[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 5.5976 |
| logD: | 5.5587 |
| logSw: | -5.9172 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.733 |
| InChI Key: | XFBKKTDUCKLVHJ-UHFFFAOYSA-N |