ethyl 3-[4-(2,4,5-trichlorobenzene-1-sulfonyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate
Chemical Structure Depiction of
ethyl 3-[4-(2,4,5-trichlorobenzene-1-sulfonyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate
ethyl 3-[4-(2,4,5-trichlorobenzene-1-sulfonyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate
Compound characteristics
| Compound ID: | V006-9507 |
| Compound Name: | ethyl 3-[4-(2,4,5-trichlorobenzene-1-sulfonyl)-1,4-diazepan-1-yl]quinoxaline-2-carboxylate |
| Molecular Weight: | 543.86 |
| Molecular Formula: | C22 H21 Cl3 N4 O4 S |
| Salt: | not_available |
| Smiles: | CCOC(c1c(nc2ccccc2n1)N1CCCN(CC1)S(c1cc(c(cc1[Cl])[Cl])[Cl])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4292 |
| logD: | 5.4292 |
| logSw: | -5.8306 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 73.931 |
| InChI Key: | WDVZXTVKHIQWEV-UHFFFAOYSA-N |