3-cyano-3-(1,3-dihydro-2H-benzimidazol-2-ylidene)-2-oxopropyl 4-benzylpiperidine-1-carbodithioate
Chemical Structure Depiction of
3-cyano-3-(1,3-dihydro-2H-benzimidazol-2-ylidene)-2-oxopropyl 4-benzylpiperidine-1-carbodithioate
3-cyano-3-(1,3-dihydro-2H-benzimidazol-2-ylidene)-2-oxopropyl 4-benzylpiperidine-1-carbodithioate
Compound characteristics
| Compound ID: | 6186-3841 |
| Compound Name: | 3-cyano-3-(1,3-dihydro-2H-benzimidazol-2-ylidene)-2-oxopropyl 4-benzylpiperidine-1-carbodithioate |
| Molecular Weight: | 448.61 |
| Molecular Formula: | C24 H24 N4 O S2 |
| Smiles: | C1CN(CCC1Cc1ccccc1)C(=S)SCC(C(C#N)=C1Nc2ccccc2N1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.227 |
| logD: | 5.2256 |
| logSw: | -5.3537 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.408 |
| InChI Key: | BPXSRTAGBYPETE-UHFFFAOYSA-N |