ethyl 3-[4-(2,3,4,5,6-pentafluorobenzoyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate
Chemical Structure Depiction of
ethyl 3-[4-(2,3,4,5,6-pentafluorobenzoyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate
ethyl 3-[4-(2,3,4,5,6-pentafluorobenzoyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate
Compound characteristics
| Compound ID: | V002-6250 |
| Compound Name: | ethyl 3-[4-(2,3,4,5,6-pentafluorobenzoyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate |
| Molecular Weight: | 494.42 |
| Molecular Formula: | C23 H19 F5 N4 O3 |
| Salt: | not_available |
| Smiles: | CCOC(c1c(nc2ccccc2n1)N1CCCN(CC1)C(c1c(c(c(c(c1F)F)F)F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7977 |
| logD: | 4.7977 |
| logSw: | -4.6563 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.868 |
| InChI Key: | CFBPXMNMYSQEPZ-UHFFFAOYSA-N |