ethyl 3-[4-(5-bromopyridine-3-carbonyl)-1,4-diazepan-1-yl]-6,7-dichloroquinoxaline-2-carboxylate
Chemical Structure Depiction of
ethyl 3-[4-(5-bromopyridine-3-carbonyl)-1,4-diazepan-1-yl]-6,7-dichloroquinoxaline-2-carboxylate
ethyl 3-[4-(5-bromopyridine-3-carbonyl)-1,4-diazepan-1-yl]-6,7-dichloroquinoxaline-2-carboxylate
Compound characteristics
| Compound ID: | V003-0428 |
| Compound Name: | ethyl 3-[4-(5-bromopyridine-3-carbonyl)-1,4-diazepan-1-yl]-6,7-dichloroquinoxaline-2-carboxylate |
| Molecular Weight: | 553.24 |
| Molecular Formula: | C22 H20 Br Cl2 N5 O3 |
| Salt: | not_available |
| Smiles: | CCOC(c1c(nc2cc(c(cc2n1)[Cl])[Cl])N1CCCN(CC1)C(c1cc(cnc1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0255 |
| logD: | 5.0255 |
| logSw: | -5.2323 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.476 |
| InChI Key: | WIPHIKSLFPJHOA-UHFFFAOYSA-N |