ethyl 3-[4-(2-chloropyridine-3-carbonyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate
Chemical Structure Depiction of
ethyl 3-[4-(2-chloropyridine-3-carbonyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate
ethyl 3-[4-(2-chloropyridine-3-carbonyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate
Compound characteristics
| Compound ID: | V018-9913 |
| Compound Name: | ethyl 3-[4-(2-chloropyridine-3-carbonyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate |
| Molecular Weight: | 439.9 |
| Molecular Formula: | C22 H22 Cl N5 O3 |
| Salt: | not_available |
| Smiles: | CCOC(c1c(nc2ccccc2n1)N1CCCN(CC1)C(c1cccnc1[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2423 |
| logD: | 3.2423 |
| logSw: | -3.5592 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.553 |
| InChI Key: | YGADLFIPFGURSG-UHFFFAOYSA-N |