ethyl 6,7-dichloro-3-[4-(3-chloro-4-fluorobenzoyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate
Chemical Structure Depiction of
ethyl 6,7-dichloro-3-[4-(3-chloro-4-fluorobenzoyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate
ethyl 6,7-dichloro-3-[4-(3-chloro-4-fluorobenzoyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate
Compound characteristics
| Compound ID: | V002-8473 |
| Compound Name: | ethyl 6,7-dichloro-3-[4-(3-chloro-4-fluorobenzoyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate |
| Molecular Weight: | 525.79 |
| Molecular Formula: | C23 H20 Cl3 F N4 O3 |
| Salt: | not_available |
| Smiles: | CCOC(c1c(nc2cc(c(cc2n1)[Cl])[Cl])N1CCCN(CC1)C(c1ccc(c(c1)[Cl])F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5515 |
| logD: | 5.5515 |
| logSw: | -5.9784 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.868 |
| InChI Key: | XRYRSBBHKXMCKB-UHFFFAOYSA-N |