ethyl 4-[2-(2,4-dimethoxyanilino)-2-oxoethyl]-5-methyl-7-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 4-[2-(2,4-dimethoxyanilino)-2-oxoethyl]-5-methyl-7-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
ethyl 4-[2-(2,4-dimethoxyanilino)-2-oxoethyl]-5-methyl-7-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | D529-0031 |
| Compound Name: | ethyl 4-[2-(2,4-dimethoxyanilino)-2-oxoethyl]-5-methyl-7-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 477.52 |
| Molecular Formula: | C25 H27 N5 O5 |
| Smiles: | CCOC(C1C(c2ccccc2)n2c(ncn2)N(CC(Nc2ccc(cc2OC)OC)=O)C=1C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4628 |
| logD: | 3.4626 |
| logSw: | -3.6221 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.6 |
| InChI Key: | OVKXUXSTZBDKHL-QHCPKHFHSA-N |