6-hydroxy-1,3-dimethyl-5-(5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one
Chemical Structure Depiction of
6-hydroxy-1,3-dimethyl-5-(5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one
6-hydroxy-1,3-dimethyl-5-(5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | D364-0456 |
| Compound Name: | 6-hydroxy-1,3-dimethyl-5-(5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one |
| Molecular Weight: | 316.38 |
| Molecular Formula: | C15 H16 N4 O2 S |
| Smiles: | CN1C(=C(C2CC(c3ccccc3)NN=2)C(N(C)C1=S)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.0254 |
| logD: | -2.3309 |
| logSw: | -2.1047 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.225 |
| InChI Key: | LNIWOTXOHGLPDR-SNVBAGLBSA-N |