2-{[(5-ethyl-4-hydroxy-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]methyl}quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(5-ethyl-4-hydroxy-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]methyl}quinazolin-4(3H)-one
2-{[(5-ethyl-4-hydroxy-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]methyl}quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | 8016-5298 |
| Compound Name: | 2-{[(5-ethyl-4-hydroxy-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]methyl}quinazolin-4(3H)-one |
| Molecular Weight: | 330.36 |
| Molecular Formula: | C15 H14 N4 O3 S |
| Smiles: | CCC1=C(N=C(NC1=O)SCC1NC(c2ccccc2N=1)=O)O |
| Stereo: | ACHIRAL |
| logP: | 0.7734 |
| logD: | -2.6817 |
| logSw: | -2.3948 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.605 |
| InChI Key: | UVFOELQHETWHRX-UHFFFAOYSA-N |