6-({[2-(5-bromo-2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-9H-purine
Chemical Structure Depiction of
6-({[2-(5-bromo-2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-9H-purine
6-({[2-(5-bromo-2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-9H-purine
Compound characteristics
| Compound ID: | D691-0082 |
| Compound Name: | 6-({[2-(5-bromo-2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-9H-purine |
| Molecular Weight: | 432.3 |
| Molecular Formula: | C17 H14 Br N5 O2 S |
| Smiles: | Cc1c(CSc2c3c(ncn2)[nH]cn3)nc(c2cc(ccc2OC)[Br])o1 |
| Stereo: | ACHIRAL |
| logP: | 3.3137 |
| logD: | 3.3136 |
| logSw: | -3.7282 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.287 |
| InChI Key: | JEIBUIQCPXUZHI-UHFFFAOYSA-N |