ethyl 6,7-dichloro-3-[4-(trichloroacetyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate
Chemical Structure Depiction of
ethyl 6,7-dichloro-3-[4-(trichloroacetyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate
ethyl 6,7-dichloro-3-[4-(trichloroacetyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate
Compound characteristics
| Compound ID: | V012-3624 |
| Compound Name: | ethyl 6,7-dichloro-3-[4-(trichloroacetyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate |
| Molecular Weight: | 514.62 |
| Molecular Formula: | C18 H17 Cl5 N4 O3 |
| Salt: | not_available |
| Smiles: | CCOC(c1c(nc2cc(c(cc2n1)[Cl])[Cl])N1CCCN(CC1)C(C([Cl])([Cl])[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3736 |
| logD: | 5.3736 |
| logSw: | -5.8813 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.14 |
| InChI Key: | VFJZEMZNHVZILW-UHFFFAOYSA-N |