1,4-bis(5-bromo-2,4-dimethylbenzene-1-sulfonyl)-1,4-diazepane
Chemical Structure Depiction of
1,4-bis(5-bromo-2,4-dimethylbenzene-1-sulfonyl)-1,4-diazepane
1,4-bis(5-bromo-2,4-dimethylbenzene-1-sulfonyl)-1,4-diazepane
Compound characteristics
| Compound ID: | 4905-1299 |
| Compound Name: | 1,4-bis(5-bromo-2,4-dimethylbenzene-1-sulfonyl)-1,4-diazepane |
| Molecular Weight: | 594.38 |
| Molecular Formula: | C21 H26 Br2 N2 O4 S2 |
| Smiles: | Cc1cc(C)c(cc1S(N1CCCN(CC1)S(c1cc(c(C)cc1C)[Br])(=O)=O)(=O)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.6298 |
| logD: | 5.6298 |
| logSw: | -5.3654 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 63.799 |
| InChI Key: | CORBNRYDJBCDMX-UHFFFAOYSA-N |