6-({[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-9H-purine
Chemical Structure Depiction of
6-({[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-9H-purine
6-({[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-9H-purine
Compound characteristics
| Compound ID: | D691-0032 |
| Compound Name: | 6-({[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-9H-purine |
| Molecular Weight: | 357.82 |
| Molecular Formula: | C16 H12 Cl N5 O S |
| Smiles: | Cc1c(CSc2c3c(ncn2)[nH]cn3)nc(c2cccc(c2)[Cl])o1 |
| Stereo: | ACHIRAL |
| logP: | 3.2636 |
| logD: | 3.2635 |
| logSw: | -3.6888 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.657 |
| InChI Key: | OZMCHXZBQNOLDA-UHFFFAOYSA-N |