9-(4-methylphenyl)-8-{[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]sulfanyl}-1,9-dihydro-6H-purin-6-one
Chemical Structure Depiction of
9-(4-methylphenyl)-8-{[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]sulfanyl}-1,9-dihydro-6H-purin-6-one
9-(4-methylphenyl)-8-{[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]sulfanyl}-1,9-dihydro-6H-purin-6-one
Compound characteristics
| Compound ID: | G754-0294 |
| Compound Name: | 9-(4-methylphenyl)-8-{[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]sulfanyl}-1,9-dihydro-6H-purin-6-one |
| Molecular Weight: | 429.5 |
| Molecular Formula: | C23 H19 N5 O2 S |
| Smiles: | Cc1ccc(cc1)n1c2c(C(NC=N2)=O)nc1SCc1c(C)oc(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.0785 |
| logD: | 4.0771 |
| logSw: | -4.1191 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.296 |
| InChI Key: | VDEOAKXYARPZEU-UHFFFAOYSA-N |