methyl 2-(4-iodo-1-methyl-1H-pyrazol-3-yl)-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
Chemical Structure Depiction of
methyl 2-(4-iodo-1-methyl-1H-pyrazol-3-yl)-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
methyl 2-(4-iodo-1-methyl-1H-pyrazol-3-yl)-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
Compound characteristics
| Compound ID: | Y502-3034 |
| Compound Name: | methyl 2-(4-iodo-1-methyl-1H-pyrazol-3-yl)-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate |
| Molecular Weight: | 454.25 |
| Molecular Formula: | C14 H11 I N6 O2 S |
| Smiles: | Cc1c2c3nc(c4c(cn(C)n4)I)nn3cnc2sc1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.4097 |
| logD: | 2.4081 |
| logSw: | -2.2123 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 67.649 |
| InChI Key: | SQEKPXKMZVZMAR-UHFFFAOYSA-N |