N-(3-methoxypropyl)-4-(4-nitrophenyl)piperazine-1-carbothioamide
Chemical Structure Depiction of
N-(3-methoxypropyl)-4-(4-nitrophenyl)piperazine-1-carbothioamide
N-(3-methoxypropyl)-4-(4-nitrophenyl)piperazine-1-carbothioamide
Compound characteristics
| Compound ID: | Y500-8881 |
| Compound Name: | N-(3-methoxypropyl)-4-(4-nitrophenyl)piperazine-1-carbothioamide |
| Molecular Weight: | 338.43 |
| Molecular Formula: | C15 H22 N4 O3 S |
| Smiles: | COCCCNC(N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O)=S |
| Stereo: | ACHIRAL |
| logP: | 2.4159 |
| logD: | 2.4159 |
| logSw: | -2.6052 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.556 |
| InChI Key: | APLGOPMDXTVZMI-UHFFFAOYSA-N |