methyl [3-oxo-1-(phenylcarbamothioyl)piperazin-2-yl]acetate
Chemical Structure Depiction of
methyl [3-oxo-1-(phenylcarbamothioyl)piperazin-2-yl]acetate
methyl [3-oxo-1-(phenylcarbamothioyl)piperazin-2-yl]acetate
Compound characteristics
| Compound ID: | 6456-0627 |
| Compound Name: | methyl [3-oxo-1-(phenylcarbamothioyl)piperazin-2-yl]acetate |
| Molecular Weight: | 307.37 |
| Molecular Formula: | C14 H17 N3 O3 S |
| Smiles: | COC(CC1C(NCCN1C(Nc1ccccc1)=S)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.9935 |
| logD: | 0.9935 |
| logSw: | -2.0847 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.266 |
| InChI Key: | GTLPHQUYEJAACF-NSHDSACASA-N |