ethyl 6,7-dichloro-3-{4-[4-(propan-2-yl)benzene-1-sulfonyl]-1,4-diazepan-1-yl}quinoxaline-2-carboxylate
Chemical Structure Depiction of
ethyl 6,7-dichloro-3-{4-[4-(propan-2-yl)benzene-1-sulfonyl]-1,4-diazepan-1-yl}quinoxaline-2-carboxylate
ethyl 6,7-dichloro-3-{4-[4-(propan-2-yl)benzene-1-sulfonyl]-1,4-diazepan-1-yl}quinoxaline-2-carboxylate
Compound characteristics
| Compound ID: | V001-5907 |
| Compound Name: | ethyl 6,7-dichloro-3-{4-[4-(propan-2-yl)benzene-1-sulfonyl]-1,4-diazepan-1-yl}quinoxaline-2-carboxylate |
| Molecular Weight: | 551.49 |
| Molecular Formula: | C25 H28 Cl2 N4 O4 S |
| Salt: | not_available |
| Smiles: | CCOC(c1c(nc2cc(c(cc2n1)[Cl])[Cl])N1CCCN(CC1)S(c1ccc(cc1)C(C)C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.6622 |
| logD: | 6.6622 |
| logSw: | -6.4339 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 73.931 |
| InChI Key: | HKHXRKIMAANWQF-UHFFFAOYSA-N |