ethyl 3-[4-(2,6-difluorobenzoyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate
Chemical Structure Depiction of
ethyl 3-[4-(2,6-difluorobenzoyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate
ethyl 3-[4-(2,6-difluorobenzoyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate
Compound characteristics
| Compound ID: | V010-6368 |
| Compound Name: | ethyl 3-[4-(2,6-difluorobenzoyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate |
| Molecular Weight: | 440.45 |
| Molecular Formula: | C23 H22 F2 N4 O3 |
| Salt: | not_available |
| Smiles: | CCOC(c1c(nc2ccccc2n1)N1CCCN(CC1)C(c1c(cccc1F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9367 |
| logD: | 3.9367 |
| logSw: | -4.0705 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.868 |
| InChI Key: | JTEHTEFXTXPNCB-UHFFFAOYSA-N |