2-ethyl 4-methyl 5-{[7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carbonyl]amino}-3-methylthiophene-2,4-dicarboxylate
Chemical Structure Depiction of
2-ethyl 4-methyl 5-{[7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carbonyl]amino}-3-methylthiophene-2,4-dicarboxylate
2-ethyl 4-methyl 5-{[7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carbonyl]amino}-3-methylthiophene-2,4-dicarboxylate
Compound characteristics
| Compound ID: | 6466-1368 |
| Compound Name: | 2-ethyl 4-methyl 5-{[7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carbonyl]amino}-3-methylthiophene-2,4-dicarboxylate |
| Molecular Weight: | 453.42 |
| Molecular Formula: | C18 H17 F2 N5 O5 S |
| Smiles: | CCOC(c1c(C)c(C(=O)OC)c(NC(c2nc3nc(C)cc(C(F)F)n3n2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0623 |
| logD: | -0.6279 |
| logSw: | -2.7668 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.672 |
| InChI Key: | GZQXENPEPQZXTD-UHFFFAOYSA-N |