1-[2-(azepan-1-yl)-2-oxoethyl]-6,7-dimethyl-3-(trifluoromethyl)quinoxalin-2(1H)-one
Chemical Structure Depiction of
1-[2-(azepan-1-yl)-2-oxoethyl]-6,7-dimethyl-3-(trifluoromethyl)quinoxalin-2(1H)-one
1-[2-(azepan-1-yl)-2-oxoethyl]-6,7-dimethyl-3-(trifluoromethyl)quinoxalin-2(1H)-one
Compound characteristics
| Compound ID: | F069-0541 |
| Compound Name: | 1-[2-(azepan-1-yl)-2-oxoethyl]-6,7-dimethyl-3-(trifluoromethyl)quinoxalin-2(1H)-one |
| Molecular Weight: | 381.4 |
| Molecular Formula: | C19 H22 F3 N3 O2 |
| Smiles: | Cc1cc2c(cc1C)N(CC(N1CCCCCC1)=O)C(C(C(F)(F)F)=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.18 |
| logD: | 3.18 |
| logSw: | -3.3729 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.173 |
| InChI Key: | HYXQJQRREMKLGO-UHFFFAOYSA-N |