6-[(furan-2-yl)methyl]-1-(4-methylphenyl)-2-sulfanylidene-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
6-[(furan-2-yl)methyl]-1-(4-methylphenyl)-2-sulfanylidene-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
6-[(furan-2-yl)methyl]-1-(4-methylphenyl)-2-sulfanylidene-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | 8017-1114 |
| Compound Name: | 6-[(furan-2-yl)methyl]-1-(4-methylphenyl)-2-sulfanylidene-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one |
| Molecular Weight: | 354.43 |
| Molecular Formula: | C18 H18 N4 O2 S |
| Smiles: | Cc1ccc(cc1)N1C2=C(CN(Cc3ccco3)CN2)C(NC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3312 |
| logD: | 2.3275 |
| logSw: | -2.7848 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.057 |
| InChI Key: | HWABHHJPMLAKKR-UHFFFAOYSA-N |