9-methyl-8-({[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methyl}sulfanyl)-1,9-dihydro-6H-purin-6-one
Chemical Structure Depiction of
9-methyl-8-({[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methyl}sulfanyl)-1,9-dihydro-6H-purin-6-one
9-methyl-8-({[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methyl}sulfanyl)-1,9-dihydro-6H-purin-6-one
Compound characteristics
| Compound ID: | J095-0006 |
| Compound Name: | 9-methyl-8-({[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methyl}sulfanyl)-1,9-dihydro-6H-purin-6-one |
| Molecular Weight: | 367.43 |
| Molecular Formula: | C18 H17 N5 O2 S |
| Smiles: | Cc1cccc(c1)c1nc(CSc2nc3C(NC=Nc3n2C)=O)c(C)o1 |
| Stereo: | ACHIRAL |
| logP: | 2.4783 |
| logD: | 2.4771 |
| logSw: | -2.7466 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.634 |
| InChI Key: | QLAYDVWGSCFURK-UHFFFAOYSA-N |