3-({4-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]cyclohexyl}methyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
3-({4-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]cyclohexyl}methyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
3-({4-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]cyclohexyl}methyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | K284-6208 |
| Compound Name: | 3-({4-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]cyclohexyl}methyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 490.67 |
| Molecular Formula: | C28 H34 N4 O2 S |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)C(C1CCC(CC1)CN1C(c2ccccc2NC1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9207 |
| logD: | 5.9195 |
| logSw: | -5.537 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.118 |
| InChI Key: | RHOHJXJPRJEWET-UHFFFAOYSA-N |