2-[(2-nitrothiophen-3-yl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-[(2-nitrothiophen-3-yl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethan-1-one
2-[(2-nitrothiophen-3-yl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | C700-1507 |
| Compound Name: | 2-[(2-nitrothiophen-3-yl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethan-1-one |
| Molecular Weight: | 363.46 |
| Molecular Formula: | C16 H17 N3 O3 S2 |
| Smiles: | C1CN(CCN1C(CSc1ccsc1[N+]([O-])=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.7361 |
| logD: | 2.7361 |
| logSw: | -2.9755 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.07 |
| InChI Key: | VATWENABYOYZAB-UHFFFAOYSA-N |