N-(4-bromophenyl)-2-[4-(5-bromothiophene-2-sulfonyl)-1,4-diazepan-1-yl]acetamide
Chemical Structure Depiction of
N-(4-bromophenyl)-2-[4-(5-bromothiophene-2-sulfonyl)-1,4-diazepan-1-yl]acetamide
N-(4-bromophenyl)-2-[4-(5-bromothiophene-2-sulfonyl)-1,4-diazepan-1-yl]acetamide
Compound characteristics
| Compound ID: | C036-1003 |
| Compound Name: | N-(4-bromophenyl)-2-[4-(5-bromothiophene-2-sulfonyl)-1,4-diazepan-1-yl]acetamide |
| Molecular Weight: | 537.29 |
| Molecular Formula: | C17 H19 Br2 N3 O3 S2 |
| Smiles: | C1CN(CCN(C1)S(c1ccc(s1)[Br])(=O)=O)CC(Nc1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.3451 |
| logD: | 4.3449 |
| logSw: | -4.1054 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.989 |
| InChI Key: | BSHUPOLUWHTHSJ-UHFFFAOYSA-N |