methyl 2-(4,5-dibromothiophen-2-yl)-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
Chemical Structure Depiction of
methyl 2-(4,5-dibromothiophen-2-yl)-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
methyl 2-(4,5-dibromothiophen-2-yl)-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
Compound characteristics
| Compound ID: | Y502-3058 |
| Compound Name: | methyl 2-(4,5-dibromothiophen-2-yl)-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate |
| Molecular Weight: | 488.18 |
| Molecular Formula: | C14 H8 Br2 N4 O2 S2 |
| Smiles: | Cc1c2c3nc(c4cc(c(s4)[Br])[Br])nn3cnc2sc1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.6744 |
| logD: | 4.6719 |
| logSw: | -4.7346 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.312 |
| InChI Key: | GOBRRDFLEVTVMA-UHFFFAOYSA-N |