N-(2,6-dichlorophenyl)-2-[4-(4-fluorobenzene-1-sulfonyl)-1,4-diazepan-1-yl]acetamide
Chemical Structure Depiction of
N-(2,6-dichlorophenyl)-2-[4-(4-fluorobenzene-1-sulfonyl)-1,4-diazepan-1-yl]acetamide
N-(2,6-dichlorophenyl)-2-[4-(4-fluorobenzene-1-sulfonyl)-1,4-diazepan-1-yl]acetamide
Compound characteristics
| Compound ID: | C036-0999 |
| Compound Name: | N-(2,6-dichlorophenyl)-2-[4-(4-fluorobenzene-1-sulfonyl)-1,4-diazepan-1-yl]acetamide |
| Molecular Weight: | 460.35 |
| Molecular Formula: | C19 H20 Cl2 F N3 O3 S |
| Smiles: | C1CN(CCN(C1)S(c1ccc(cc1)F)(=O)=O)CC(Nc1c(cccc1[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.1402 |
| logD: | 4.1236 |
| logSw: | -4.3335 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.575 |
| InChI Key: | PKJSFYQVFQBXTK-UHFFFAOYSA-N |