2-{5-[(2,4-dichlorophenoxy)methyl]furan-2-yl}-7-methyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-{5-[(2,4-dichlorophenoxy)methyl]furan-2-yl}-7-methyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
2-{5-[(2,4-dichlorophenoxy)methyl]furan-2-yl}-7-methyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
Compound ID: | Y502-4082 |
Compound Name: | 2-{5-[(2,4-dichlorophenoxy)methyl]furan-2-yl}-7-methyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
Molecular Weight: | 415.24 |
Molecular Formula: | C18 H12 Cl2 N6 O2 |
Smiles: | Cn1c2c(cn1)c1nc(c3ccc(COc4ccc(cc4[Cl])[Cl])o3)nn1cn2 |
Stereo: | ACHIRAL |
logP: | 3.6217 |
logD: | 3.6198 |
logSw: | -3.6501 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 60.019 |
InChI Key: | QOOZCKCILLDPRG-UHFFFAOYSA-N |