6-cyclopentyl-1-(2-phenylethyl)-2-sulfanylidene-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
6-cyclopentyl-1-(2-phenylethyl)-2-sulfanylidene-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
6-cyclopentyl-1-(2-phenylethyl)-2-sulfanylidene-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | 7834-0129 |
| Compound Name: | 6-cyclopentyl-1-(2-phenylethyl)-2-sulfanylidene-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one |
| Molecular Weight: | 356.49 |
| Molecular Formula: | C19 H24 N4 O S |
| Smiles: | C1CCC(C1)N1CC2=C(NC1)N(CCc1ccccc1)C(NC2=O)=S |
| Stereo: | ACHIRAL |
| logP: | 2.8537 |
| logD: | 1.6281 |
| logSw: | -3.4166 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 40.818 |
| InChI Key: | IGDACYSBVCARCM-UHFFFAOYSA-N |