1-(5-chloro-2-hydroxyphenyl)-4-[(4-fluorophenyl)methyl][1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Chemical Structure Depiction of
1-(5-chloro-2-hydroxyphenyl)-4-[(4-fluorophenyl)methyl][1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
1-(5-chloro-2-hydroxyphenyl)-4-[(4-fluorophenyl)methyl][1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Compound characteristics
| Compound ID: | E143-0101 |
| Compound Name: | 1-(5-chloro-2-hydroxyphenyl)-4-[(4-fluorophenyl)methyl][1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one |
| Molecular Weight: | 420.83 |
| Molecular Formula: | C22 H14 Cl F N4 O2 |
| Smiles: | C(c1ccc(cc1)F)N1C(c2ccccc2n2c(c3cc(ccc3O)[Cl])nnc12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8596 |
| logD: | 4.6623 |
| logSw: | -4.5346 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.278 |
| InChI Key: | KJIFTDRCANROHB-UHFFFAOYSA-N |