6-benzyl-1-(2-methylphenyl)-2-sulfanylidene-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
6-benzyl-1-(2-methylphenyl)-2-sulfanylidene-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
6-benzyl-1-(2-methylphenyl)-2-sulfanylidene-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | 8213-0024 |
| Compound Name: | 6-benzyl-1-(2-methylphenyl)-2-sulfanylidene-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one |
| Molecular Weight: | 364.47 |
| Molecular Formula: | C20 H20 N4 O S |
| Smiles: | Cc1ccccc1N1C2=C(CN(Cc3ccccc3)CN2)C(NC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9284 |
| logD: | 2.9168 |
| logSw: | -3.2941 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 40.008 |
| InChI Key: | XDQLHGACKCNLRG-UHFFFAOYSA-N |