4-(4-ethylpiperazin-1-yl)-2-(methylsulfanyl)-6-phenylpyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-(4-ethylpiperazin-1-yl)-2-(methylsulfanyl)-6-phenylpyrimidine-5-carbonitrile
4-(4-ethylpiperazin-1-yl)-2-(methylsulfanyl)-6-phenylpyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D287-0053 |
| Compound Name: | 4-(4-ethylpiperazin-1-yl)-2-(methylsulfanyl)-6-phenylpyrimidine-5-carbonitrile |
| Molecular Weight: | 339.46 |
| Molecular Formula: | C18 H21 N5 S |
| Smiles: | CCN1CCN(CC1)c1c(C#N)c(c2ccccc2)nc(n1)SC |
| Stereo: | ACHIRAL |
| logP: | 3.4952 |
| logD: | 3.1464 |
| logSw: | -3.6838 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.009 |
| InChI Key: | ASMTVHKICVUCFJ-UHFFFAOYSA-N |