N-(2-bromophenyl)-2-[4-(4-fluorobenzene-1-sulfonyl)-1,4-diazepan-1-yl]acetamide
Chemical Structure Depiction of
N-(2-bromophenyl)-2-[4-(4-fluorobenzene-1-sulfonyl)-1,4-diazepan-1-yl]acetamide
N-(2-bromophenyl)-2-[4-(4-fluorobenzene-1-sulfonyl)-1,4-diazepan-1-yl]acetamide
Compound characteristics
| Compound ID: | C036-0366 |
| Compound Name: | N-(2-bromophenyl)-2-[4-(4-fluorobenzene-1-sulfonyl)-1,4-diazepan-1-yl]acetamide |
| Molecular Weight: | 470.36 |
| Molecular Formula: | C19 H21 Br F N3 O3 S |
| Smiles: | C1CN(CCN(C1)S(c1ccc(cc1)F)(=O)=O)CC(Nc1ccccc1[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.2744 |
| logD: | 3.2744 |
| logSw: | -3.4428 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.272 |
| InChI Key: | PLZVJNQAZLIJEI-UHFFFAOYSA-N |