1-{3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-4-{3-[(propan-2-yl)oxy]propyl}[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Chemical Structure Depiction of
1-{3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-4-{3-[(propan-2-yl)oxy]propyl}[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
1-{3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-4-{3-[(propan-2-yl)oxy]propyl}[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Compound characteristics
| Compound ID: | C741-1171 |
| Compound Name: | 1-{3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-4-{3-[(propan-2-yl)oxy]propyl}[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one |
| Molecular Weight: | 520.61 |
| Molecular Formula: | C28 H33 F N6 O3 |
| Smiles: | CC(C)OCCCN1C(c2ccccc2n2c(CCC(N3CCN(CC3)c3ccc(cc3)F)=O)nnc12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3444 |
| logD: | 2.3443 |
| logSw: | -2.7833 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 66.81 |
| InChI Key: | MTHQSGXASWFGSV-UHFFFAOYSA-N |