ethyl 2-[(5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-7-carbonyl)amino]-4-phenylthiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[(5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-7-carbonyl)amino]-4-phenylthiophene-3-carboxylate
ethyl 2-[(5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-7-carbonyl)amino]-4-phenylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y505-2803 |
| Compound Name: | ethyl 2-[(5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-7-carbonyl)amino]-4-phenylthiophene-3-carboxylate |
| Molecular Weight: | 407.45 |
| Molecular Formula: | C20 H17 N5 O3 S |
| Smiles: | CCOC(c1c(csc1NC(c1cc(C)nc2ncnn12)=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9726 |
| logD: | 2.6949 |
| logSw: | -3.4284 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.168 |
| InChI Key: | XCTBYALXDLRGBG-UHFFFAOYSA-N |