methyl 3-[(4-cyclohexylpiperazine-1-carbothioyl)amino]thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-[(4-cyclohexylpiperazine-1-carbothioyl)amino]thiophene-2-carboxylate
methyl 3-[(4-cyclohexylpiperazine-1-carbothioyl)amino]thiophene-2-carboxylate
Compound characteristics
| Compound ID: | C200-1591 |
| Compound Name: | methyl 3-[(4-cyclohexylpiperazine-1-carbothioyl)amino]thiophene-2-carboxylate |
| Molecular Weight: | 367.53 |
| Molecular Formula: | C17 H25 N3 O2 S2 |
| Smiles: | COC(c1c(ccs1)NC(N1CCN(CC1)C1CCCCC1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6452 |
| logD: | 2.6137 |
| logSw: | -3.7985 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.724 |
| InChI Key: | WLMVNNDIXXLCOP-UHFFFAOYSA-N |