ethyl 5-methyl-7-(4-methylphenyl)-4-{2-oxo-2-[(prop-2-en-1-yl)amino]ethyl}-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 5-methyl-7-(4-methylphenyl)-4-{2-oxo-2-[(prop-2-en-1-yl)amino]ethyl}-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
ethyl 5-methyl-7-(4-methylphenyl)-4-{2-oxo-2-[(prop-2-en-1-yl)amino]ethyl}-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | D529-0173 |
| Compound Name: | ethyl 5-methyl-7-(4-methylphenyl)-4-{2-oxo-2-[(prop-2-en-1-yl)amino]ethyl}-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 395.46 |
| Molecular Formula: | C21 H25 N5 O3 |
| Smiles: | CCOC(C1C(c2ccc(C)cc2)n2c(ncn2)N(CC(NCC=C)=O)C=1C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.449 |
| logD: | 2.449 |
| logSw: | -2.7663 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.559 |
| InChI Key: | RMMHRKNHSZKNKJ-IBGZPJMESA-N |