2,9-dimethyl-8-{[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]sulfanyl}-1,9-dihydro-6H-purin-6-one
Chemical Structure Depiction of
2,9-dimethyl-8-{[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]sulfanyl}-1,9-dihydro-6H-purin-6-one
2,9-dimethyl-8-{[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]sulfanyl}-1,9-dihydro-6H-purin-6-one
Compound characteristics
| Compound ID: | J095-0245 |
| Compound Name: | 2,9-dimethyl-8-{[(5-methyl-2-phenyl-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: | CC1NC(c2c(N=1)n(C)c(n2)SCc1c(C)oc(c2ccccc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7674 |
| logD: | 2.7508 |
| logSw: | -3.23 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.534 |
| InChI Key: | UQRZCMPZYZLOIE-UHFFFAOYSA-N |