4-(1-methyl-2,4-dioxo-1,2,3,4,7,8-hexahydropyrimido[2,1-f]purin-9(6H)-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
4-(1-methyl-2,4-dioxo-1,2,3,4,7,8-hexahydropyrimido[2,1-f]purin-9(6H)-yl)benzene-1-sulfonamide
4-(1-methyl-2,4-dioxo-1,2,3,4,7,8-hexahydropyrimido[2,1-f]purin-9(6H)-yl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 8578-0231 |
| Compound Name: | 4-(1-methyl-2,4-dioxo-1,2,3,4,7,8-hexahydropyrimido[2,1-f]purin-9(6H)-yl)benzene-1-sulfonamide |
| Molecular Weight: | 376.39 |
| Molecular Formula: | C15 H16 N6 O4 S |
| Smiles: | CN1C(NC(c2c1nc1N(CCCn12)c1ccc(cc1)S(N)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5741 |
| logD: | 0.573 |
| logSw: | -2.1722 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 104.337 |
| InChI Key: | RTHLOITUVXSAAB-UHFFFAOYSA-N |