8-({[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-2,5-dimethylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazine
Chemical Structure Depiction of
8-({[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-2,5-dimethylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazine
8-({[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-2,5-dimethylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazine
Compound characteristics
| Compound ID: | E514-0517 |
| Compound Name: | 8-({[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-2,5-dimethylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazine |
| Molecular Weight: | 450.52 |
| Molecular Formula: | C23 H22 N4 O4 S |
| Smiles: | Cc1nnc(c2cc3c(cc(C)o3)n12)SCc1c(C)oc(c2ccc(c(c2)OC)OC)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.8098 |
| logD: | 3.8067 |
| logSw: | -4.0529 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.465 |
| InChI Key: | TWDKYNHFGMAVDZ-UHFFFAOYSA-N |