2-bromo-N-(4-methylpiperazine-1-carbothioyl)benzamide
Chemical Structure Depiction of
2-bromo-N-(4-methylpiperazine-1-carbothioyl)benzamide
2-bromo-N-(4-methylpiperazine-1-carbothioyl)benzamide
Compound characteristics
| Compound ID: | 8012-5010 |
| Compound Name: | 2-bromo-N-(4-methylpiperazine-1-carbothioyl)benzamide |
| Molecular Weight: | 342.25 |
| Molecular Formula: | C13 H16 Br N3 O S |
| Smiles: | CN1CCN(CC1)C(NC(c1ccccc1[Br])=O)=S |
| Stereo: | ACHIRAL |
| logP: | 1.7171 |
| logD: | 0.922 |
| logSw: | -2.6624 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.7921 |
| InChI Key: | TXAQZLQLRLERHS-UHFFFAOYSA-N |