6-methyl-N-(3-nitrophenyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-sulfonamide
Chemical Structure Depiction of
6-methyl-N-(3-nitrophenyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-sulfonamide
6-methyl-N-(3-nitrophenyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-sulfonamide
Compound characteristics
Compound ID: | E214-0068 |
Compound Name: | 6-methyl-N-(3-nitrophenyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-sulfonamide |
Molecular Weight: | 326.28 |
Molecular Formula: | C11 H10 N4 O6 S |
Smiles: | CC1=C(C(NC(N1)=O)=O)S(Nc1cccc(c1)[N+]([O-])=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 0.5883 |
logD: | -3.1678 |
logSw: | -2.4808 |
Hydrogen bond acceptors count: | 12 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 122.804 |
InChI Key: | CKBXSKNUGJBECF-UHFFFAOYSA-N |