2-[(3,4-diethoxyphenyl)methyl]-10-methyl-11-(1-methyl-1H-pyrazol-4-yl)-9,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-[(3,4-diethoxyphenyl)methyl]-10-methyl-11-(1-methyl-1H-pyrazol-4-yl)-9,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
2-[(3,4-diethoxyphenyl)methyl]-10-methyl-11-(1-methyl-1H-pyrazol-4-yl)-9,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y503-4776 |
| Compound Name: | 2-[(3,4-diethoxyphenyl)methyl]-10-methyl-11-(1-methyl-1H-pyrazol-4-yl)-9,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 486.53 |
| Molecular Formula: | C25 H26 N8 O3 |
| Smiles: | CCOc1ccc(Cc2nc3C4C(c5cnn(C)c5)c5c(n[nH]c5C)OC=4N=Cn3n2)cc1OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0351 |
| logD: | -0.5832 |
| logSw: | -2.4955 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.785 |
| InChI Key: | PEOAGKXOTHGOFR-OAQYLSRUSA-N |