6-cyclohexyl-1-(2-phenylethyl)-2-sulfanylidene-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
6-cyclohexyl-1-(2-phenylethyl)-2-sulfanylidene-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
6-cyclohexyl-1-(2-phenylethyl)-2-sulfanylidene-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | 8017-1112 |
| Compound Name: | 6-cyclohexyl-1-(2-phenylethyl)-2-sulfanylidene-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one |
| Molecular Weight: | 370.52 |
| Molecular Formula: | C20 H26 N4 O S |
| Smiles: | C1CCC(CC1)N1CC2=C(NC1)N(CCc1ccccc1)C(NC2=O)=S |
| Stereo: | ACHIRAL |
| logP: | 3.4002 |
| logD: | 2.4091 |
| logSw: | -3.678 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 40.452 |
| InChI Key: | CLXFCVGFVSBGKX-UHFFFAOYSA-N |