ethyl 7-(4-methoxyphenyl)-5-methyl-2-({[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]methyl}sulfanyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 7-(4-methoxyphenyl)-5-methyl-2-({[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]methyl}sulfanyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
ethyl 7-(4-methoxyphenyl)-5-methyl-2-({[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]methyl}sulfanyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | C202-1043 |
| Compound Name: | ethyl 7-(4-methoxyphenyl)-5-methyl-2-({[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]methyl}sulfanyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 579.68 |
| Molecular Formula: | C32 H29 N5 O4 S |
| Smiles: | CCOC(C1C(c2ccc(cc2)OC)n2c(NC=1C)nc(n2)SCc1ccc(cc1)c1ncc(c2ccccc2)o1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.7697 |
| logD: | 6.6687 |
| logSw: | -5.6472 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.249 |
| InChI Key: | GSAQOLHJXOQMLX-NDEPHWFRSA-N |