3-{[4-(4-phenylpiperazine-1-carbonyl)cyclohexyl]methyl}-2-sulfanylidene-2,3-dihydrothieno[3,2-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
3-{[4-(4-phenylpiperazine-1-carbonyl)cyclohexyl]methyl}-2-sulfanylidene-2,3-dihydrothieno[3,2-d]pyrimidin-4(1H)-one
3-{[4-(4-phenylpiperazine-1-carbonyl)cyclohexyl]methyl}-2-sulfanylidene-2,3-dihydrothieno[3,2-d]pyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | K292-1591 |
| Compound Name: | 3-{[4-(4-phenylpiperazine-1-carbonyl)cyclohexyl]methyl}-2-sulfanylidene-2,3-dihydrothieno[3,2-d]pyrimidin-4(1H)-one |
| Molecular Weight: | 468.64 |
| Molecular Formula: | C24 H28 N4 O2 S2 |
| Smiles: | C1CC(CCC1CN1C(c2c(ccs2)NC1=S)=O)C(N1CCN(CC1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4444 |
| logD: | 4.4437 |
| logSw: | -4.3176 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.437 |
| InChI Key: | BRPPLSOLUCRHIZ-UHFFFAOYSA-N |