6-hydroxy-3-methyl-5-[5-(4-nitrophenyl)-1-propanoyl-4,5-dihydro-1H-pyrazol-3-yl]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
6-hydroxy-3-methyl-5-[5-(4-nitrophenyl)-1-propanoyl-4,5-dihydro-1H-pyrazol-3-yl]pyrimidine-2,4(1H,3H)-dione
6-hydroxy-3-methyl-5-[5-(4-nitrophenyl)-1-propanoyl-4,5-dihydro-1H-pyrazol-3-yl]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
Compound ID: | D364-1807 |
Compound Name: | 6-hydroxy-3-methyl-5-[5-(4-nitrophenyl)-1-propanoyl-4,5-dihydro-1H-pyrazol-3-yl]pyrimidine-2,4(1H,3H)-dione |
Molecular Weight: | 387.35 |
Molecular Formula: | C17 H17 N5 O6 |
Smiles: | CCC(N1C(CC(C2=C(NC(N(C)C2=O)=O)O)=N1)c1ccc(cc1)[N+]([O-])=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 1.3328 |
logD: | -3.7326 |
logSw: | -2.2907 |
Hydrogen bond acceptors count: | 12 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 116.69 |
InChI Key: | MHOXXNAKBCFYFD-LBPRGKRZSA-N |