N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-2-[(2-nitrothiophen-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-2-[(2-nitrothiophen-3-yl)sulfanyl]acetamide
N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-2-[(2-nitrothiophen-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | C700-0962 |
| Compound Name: | N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-2-[(2-nitrothiophen-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 438.54 |
| Molecular Formula: | C19 H23 F N4 O3 S2 |
| Smiles: | C(CNC(CSc1ccsc1[N+]([O-])=O)=O)CN1CCN(CC1)c1ccccc1F |
| Stereo: | ACHIRAL |
| logP: | 2.465 |
| logD: | 2.1338 |
| logSw: | -2.6853 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.672 |
| InChI Key: | IISPTVXPKNQSAB-UHFFFAOYSA-N |