1-(2-methoxyethyl)-3-{4-[2-(trifluoromethoxy)benzoyl]-1,4-diazepan-1-yl}pyrrolidin-2-one
Chemical Structure Depiction of
1-(2-methoxyethyl)-3-{4-[2-(trifluoromethoxy)benzoyl]-1,4-diazepan-1-yl}pyrrolidin-2-one
1-(2-methoxyethyl)-3-{4-[2-(trifluoromethoxy)benzoyl]-1,4-diazepan-1-yl}pyrrolidin-2-one
Compound characteristics
| Compound ID: | T991-1889 |
| Compound Name: | 1-(2-methoxyethyl)-3-{4-[2-(trifluoromethoxy)benzoyl]-1,4-diazepan-1-yl}pyrrolidin-2-one |
| Molecular Weight: | 429.44 |
| Molecular Formula: | C20 H26 F3 N3 O4 |
| Smiles: | COCCN1CCC(C1=O)N1CCCN(CC1)C(c1ccccc1OC(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8723 |
| logD: | 1.8668 |
| logSw: | -2.5254 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.185 |
| InChI Key: | UMXXMDYJBCUIJW-INIZCTEOSA-N |