ethyl 6,7-dichloro-3-[4-(2,3,4,5,6-pentamethylbenzene-1-sulfonyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate
Chemical Structure Depiction of
ethyl 6,7-dichloro-3-[4-(2,3,4,5,6-pentamethylbenzene-1-sulfonyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate
ethyl 6,7-dichloro-3-[4-(2,3,4,5,6-pentamethylbenzene-1-sulfonyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate
Compound characteristics
| Compound ID: | V006-1727 |
| Compound Name: | ethyl 6,7-dichloro-3-[4-(2,3,4,5,6-pentamethylbenzene-1-sulfonyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate |
| Molecular Weight: | 579.55 |
| Molecular Formula: | C27 H32 Cl2 N4 O4 S |
| Salt: | not_available |
| Smiles: | CCOC(c1c(nc2cc(c(cc2n1)[Cl])[Cl])N1CCCN(CC1)S(c1c(C)c(C)c(C)c(C)c1C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.3972 |
| logD: | 7.3972 |
| logSw: | -6.4575 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 73.931 |
| InChI Key: | BIKQHFOIDYYIJP-UHFFFAOYSA-N |