methyl 3-[(4-ethylpiperazine-1-carbothioyl)amino]thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-[(4-ethylpiperazine-1-carbothioyl)amino]thiophene-2-carboxylate
methyl 3-[(4-ethylpiperazine-1-carbothioyl)amino]thiophene-2-carboxylate
Compound characteristics
| Compound ID: | C200-1784 |
| Compound Name: | methyl 3-[(4-ethylpiperazine-1-carbothioyl)amino]thiophene-2-carboxylate |
| Molecular Weight: | 313.44 |
| Molecular Formula: | C13 H19 N3 O2 S2 |
| Smiles: | CCN1CCN(CC1)C(Nc1ccsc1C(=O)OC)=S |
| Stereo: | ACHIRAL |
| logP: | 2.1509 |
| logD: | 1.0803 |
| logSw: | -2.6905 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.168 |
| InChI Key: | RQMTZVQVIDFILT-UHFFFAOYSA-N |