7-(4-chlorophenyl)-2-{[2-methyl-5-(propan-2-yl)phenoxy]methyl}-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
7-(4-chlorophenyl)-2-{[2-methyl-5-(propan-2-yl)phenoxy]methyl}-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
7-(4-chlorophenyl)-2-{[2-methyl-5-(propan-2-yl)phenoxy]methyl}-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | D049-0315 |
| Compound Name: | 7-(4-chlorophenyl)-2-{[2-methyl-5-(propan-2-yl)phenoxy]methyl}-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 432.91 |
| Molecular Formula: | C23 H21 Cl N6 O |
| Smiles: | CC(C)c1ccc(C)c(c1)OCc1nc2c3cnn(c4ccc(cc4)[Cl])c3ncn2n1 |
| Stereo: | ACHIRAL |
| logP: | 5.7642 |
| logD: | 5.7639 |
| logSw: | -6.3095 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 53.018 |
| InChI Key: | LSIYEBSKYROBOM-UHFFFAOYSA-N |