5-[4-(2,3-dimethylphenyl)piperazine-1-sulfonyl]-2-hydroxy-6-methylpyrimidin-4(3H)-one
Chemical Structure Depiction of
5-[4-(2,3-dimethylphenyl)piperazine-1-sulfonyl]-2-hydroxy-6-methylpyrimidin-4(3H)-one
5-[4-(2,3-dimethylphenyl)piperazine-1-sulfonyl]-2-hydroxy-6-methylpyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | D668-0359 |
| Compound Name: | 5-[4-(2,3-dimethylphenyl)piperazine-1-sulfonyl]-2-hydroxy-6-methylpyrimidin-4(3H)-one |
| Molecular Weight: | 378.45 |
| Molecular Formula: | C17 H22 N4 O4 S |
| Smiles: | CC1=C(C(NC(=N1)O)=O)S(N1CCN(CC1)c1cccc(C)c1C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0378 |
| logD: | -5.599 |
| logSw: | -2.2073 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.689 |
| InChI Key: | WNZPIUJYORZCDS-UHFFFAOYSA-N |