6-({[5-methyl-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-4-yl]methyl}sulfanyl)-9H-purine
Chemical Structure Depiction of
6-({[5-methyl-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-4-yl]methyl}sulfanyl)-9H-purine
6-({[5-methyl-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-4-yl]methyl}sulfanyl)-9H-purine
Compound characteristics
| Compound ID: | D691-0085 |
| Compound Name: | 6-({[5-methyl-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-4-yl]methyl}sulfanyl)-9H-purine |
| Molecular Weight: | 413.45 |
| Molecular Formula: | C19 H19 N5 O4 S |
| Smiles: | Cc1c(CSc2c3c(ncn2)[nH]cn3)nc(c2cc(c(c(c2)OC)OC)OC)o1 |
| Stereo: | ACHIRAL |
| logP: | 2.2586 |
| logD: | 2.2585 |
| logSw: | -2.3976 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.635 |
| InChI Key: | SCUMPXZUNVTOBJ-UHFFFAOYSA-N |