2-(2-chlorophenyl)-4-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
Chemical Structure Depiction of
2-(2-chlorophenyl)-4-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
2-(2-chlorophenyl)-4-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
Compound characteristics
| Compound ID: | G199-0518 |
| Compound Name: | 2-(2-chlorophenyl)-4-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one |
| Molecular Weight: | 440.87 |
| Molecular Formula: | C19 H13 Cl N6 O3 S |
| Smiles: | CC1=CC2=NC(CSC3=NC(c4ccccc4[Cl])=NC4=CC(NN34)=O)=CC(N2O1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8085 |
| logD: | 1.8085 |
| logSw: | -3.0199 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.396 |
| InChI Key: | GGBIVLRYDOFKHZ-UHFFFAOYSA-N |