methyl 2-(4-bromophenyl)-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
Chemical Structure Depiction of
methyl 2-(4-bromophenyl)-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
methyl 2-(4-bromophenyl)-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
Compound characteristics
| Compound ID: | Y502-2161 |
| Compound Name: | methyl 2-(4-bromophenyl)-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate |
| Molecular Weight: | 403.25 |
| Molecular Formula: | C16 H11 Br N4 O2 S |
| Smiles: | Cc1c2c3nc(c4ccc(cc4)[Br])nn3cnc2sc1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.3692 |
| logD: | 4.3651 |
| logSw: | -4.6113 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.293 |
| InChI Key: | NXJVNIKAVKZGRW-UHFFFAOYSA-N |