4-[4-cyano-1-(propan-2-yl)-5,6,7,8-tetrahydroisoquinolin-3-yl]-N-cyclohexylpiperazine-1-carbothioamide
Chemical Structure Depiction of
4-[4-cyano-1-(propan-2-yl)-5,6,7,8-tetrahydroisoquinolin-3-yl]-N-cyclohexylpiperazine-1-carbothioamide
4-[4-cyano-1-(propan-2-yl)-5,6,7,8-tetrahydroisoquinolin-3-yl]-N-cyclohexylpiperazine-1-carbothioamide
Compound characteristics
| Compound ID: | 4576-0147 |
| Compound Name: | 4-[4-cyano-1-(propan-2-yl)-5,6,7,8-tetrahydroisoquinolin-3-yl]-N-cyclohexylpiperazine-1-carbothioamide |
| Molecular Weight: | 425.64 |
| Molecular Formula: | C24 H35 N5 S |
| Smiles: | CC(C)c1c2CCCCc2c(C#N)c(n1)N1CCN(CC1)C(NC1CCCCC1)=S |
| Stereo: | ACHIRAL |
| logP: | 6.4288 |
| logD: | 6.4285 |
| logSw: | -5.798 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.741 |
| InChI Key: | QXNZUCBGDLTPKS-UHFFFAOYSA-N |