N-[5-(azepane-1-sulfonyl)-2-(azepan-1-yl)phenyl]-N'-(2-fluorophenyl)thiourea
Chemical Structure Depiction of
N-[5-(azepane-1-sulfonyl)-2-(azepan-1-yl)phenyl]-N'-(2-fluorophenyl)thiourea
N-[5-(azepane-1-sulfonyl)-2-(azepan-1-yl)phenyl]-N'-(2-fluorophenyl)thiourea
Compound characteristics
| Compound ID: | K788-0174 |
| Compound Name: | N-[5-(azepane-1-sulfonyl)-2-(azepan-1-yl)phenyl]-N'-(2-fluorophenyl)thiourea |
| Molecular Weight: | 504.69 |
| Molecular Formula: | C25 H33 F N4 O2 S2 |
| Smiles: | C1CCCN(CC1)c1ccc(cc1NC(Nc1ccccc1F)=S)S(N1CCCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1792 |
| logD: | 6.1681 |
| logSw: | -6.0035 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.19 |
| InChI Key: | LISHSAJFKAOTOI-UHFFFAOYSA-N |