9-(4-methylphenyl)-8-({[5-methyl-2-(thiophen-2-yl)-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-(thiophen-2-yl)-1,3-oxazol-4-yl]methyl}sulfanyl)-1,9-dihydro-6H-purin-6-one
9-(4-methylphenyl)-8-({[5-methyl-2-(thiophen-2-yl)-1,3-oxazol-4-yl]methyl}sulfanyl)-1,9-dihydro-6H-purin-6-one
Compound characteristics
| Compound ID: | G754-0350 |
| Compound Name: | 9-(4-methylphenyl)-8-({[5-methyl-2-(thiophen-2-yl)-1,3-oxazol-4-yl]methyl}sulfanyl)-1,9-dihydro-6H-purin-6-one |
| Molecular Weight: | 435.52 |
| Molecular Formula: | C21 H17 N5 O2 S2 |
| Smiles: | Cc1ccc(cc1)n1c2c(C(NC=N2)=O)nc1SCc1c(C)oc(c2cccs2)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.0252 |
| logD: | 4.0238 |
| logSw: | -4.0172 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.314 |
| InChI Key: | QJBBYQCPYXBWEO-UHFFFAOYSA-N |