[2-(3-methyl-1,2,4-oxadiazol-5-yl)-4-{[4-(trifluoromethyl)phenyl]methyl}-1,4-diazepan-1-yl](phenyl)methanone
Chemical Structure Depiction of
[2-(3-methyl-1,2,4-oxadiazol-5-yl)-4-{[4-(trifluoromethyl)phenyl]methyl}-1,4-diazepan-1-yl](phenyl)methanone
[2-(3-methyl-1,2,4-oxadiazol-5-yl)-4-{[4-(trifluoromethyl)phenyl]methyl}-1,4-diazepan-1-yl](phenyl)methanone
Compound characteristics
| Compound ID: | SA52-1926 |
| Compound Name: | [2-(3-methyl-1,2,4-oxadiazol-5-yl)-4-{[4-(trifluoromethyl)phenyl]methyl}-1,4-diazepan-1-yl](phenyl)methanone |
| Molecular Weight: | 444.46 |
| Molecular Formula: | C23 H23 F3 N4 O2 |
| Smiles: | Cc1nc(C2CN(CCCN2C(c2ccccc2)=O)Cc2ccc(cc2)C(F)(F)F)on1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8153 |
| logD: | 3.6049 |
| logSw: | -3.8312 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.676 |
| InChI Key: | CNPGCYYUNHPUSU-FQEVSTJZSA-N |