methyl 5-methyl-2-[(5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-7-carbonyl)amino]thiophene-3-carboxylate
Chemical Structure Depiction of
methyl 5-methyl-2-[(5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-7-carbonyl)amino]thiophene-3-carboxylate
methyl 5-methyl-2-[(5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-7-carbonyl)amino]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y505-2718 |
| Compound Name: | methyl 5-methyl-2-[(5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-7-carbonyl)amino]thiophene-3-carboxylate |
| Molecular Weight: | 331.35 |
| Molecular Formula: | C14 H13 N5 O3 S |
| Smiles: | Cc1cc(C(Nc2c(cc(C)s2)C(=O)OC)=O)n2c(ncn2)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.6255 |
| logD: | -0.911 |
| logSw: | -2.4946 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.859 |
| InChI Key: | LYLXDHPERBHRFR-UHFFFAOYSA-N |