1-(5-bromothiophene-2-sulfonyl)-4-[(2,6-dichlorophenyl)methyl]-1,4-diazepane
Chemical Structure Depiction of
1-(5-bromothiophene-2-sulfonyl)-4-[(2,6-dichlorophenyl)methyl]-1,4-diazepane
1-(5-bromothiophene-2-sulfonyl)-4-[(2,6-dichlorophenyl)methyl]-1,4-diazepane
Compound characteristics
| Compound ID: | C036-1011 |
| Compound Name: | 1-(5-bromothiophene-2-sulfonyl)-4-[(2,6-dichlorophenyl)methyl]-1,4-diazepane |
| Molecular Weight: | 484.26 |
| Molecular Formula: | C16 H17 Br Cl2 N2 O2 S2 |
| Smiles: | C1CN(CCN(C1)S(c1ccc(s1)[Br])(=O)=O)Cc1c(cccc1[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.6602 |
| logD: | 4.6591 |
| logSw: | -4.7902 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 36.839 |
| InChI Key: | FTLPZLKPZGOWFO-UHFFFAOYSA-N |