8-({[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-9-ethyl-1,9-dihydro-6H-purin-6-one
Chemical Structure Depiction of
8-({[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-9-ethyl-1,9-dihydro-6H-purin-6-one
8-({[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-9-ethyl-1,9-dihydro-6H-purin-6-one
Compound characteristics
| Compound ID: | G754-0036 |
| Compound Name: | 8-({[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-9-ethyl-1,9-dihydro-6H-purin-6-one |
| Molecular Weight: | 401.87 |
| Molecular Formula: | C18 H16 Cl N5 O2 S |
| Smiles: | CCn1c2c(C(NC=N2)=O)nc1SCc1c(C)oc(c2cccc(c2)[Cl])n1 |
| Stereo: | ACHIRAL |
| logP: | 3.3846 |
| logD: | 3.3819 |
| logSw: | -3.8437 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.549 |
| InChI Key: | ZBESTFPGSZBKFS-UHFFFAOYSA-N |