1,4-bis(5-bromo-2-methoxybenzene-1-sulfonyl)-1,4-diazepane
Chemical Structure Depiction of
1,4-bis(5-bromo-2-methoxybenzene-1-sulfonyl)-1,4-diazepane
1,4-bis(5-bromo-2-methoxybenzene-1-sulfonyl)-1,4-diazepane
Compound characteristics
| Compound ID: | 3771-4820 |
| Compound Name: | 1,4-bis(5-bromo-2-methoxybenzene-1-sulfonyl)-1,4-diazepane |
| Molecular Weight: | 598.33 |
| Molecular Formula: | C19 H22 Br2 N2 O6 S2 |
| Smiles: | COc1ccc(cc1S(N1CCCN(CC1)S(c1cc(ccc1OC)[Br])(=O)=O)(=O)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.6814 |
| logD: | 3.6814 |
| logSw: | -3.9301 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 79.06 |
| InChI Key: | OFEXMALLLAOAAT-UHFFFAOYSA-N |