1-(4-hydroxyphenyl)-4-{3-[(propan-2-yl)oxy]propyl}[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Chemical Structure Depiction of
1-(4-hydroxyphenyl)-4-{3-[(propan-2-yl)oxy]propyl}[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
1-(4-hydroxyphenyl)-4-{3-[(propan-2-yl)oxy]propyl}[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Compound characteristics
| Compound ID: | E143-0352 |
| Compound Name: | 1-(4-hydroxyphenyl)-4-{3-[(propan-2-yl)oxy]propyl}[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one |
| Molecular Weight: | 378.43 |
| Molecular Formula: | C21 H22 N4 O3 |
| Smiles: | CC(C)OCCCN1C(c2ccccc2n2c(c3ccc(cc3)O)nnc12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5772 |
| logD: | 2.5687 |
| logSw: | -2.9248 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.798 |
| InChI Key: | IJLMTVDVUHMUFE-UHFFFAOYSA-N |