1-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]-4-{3-[(propan-2-yl)oxy]propyl}[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Chemical Structure Depiction of
1-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]-4-{3-[(propan-2-yl)oxy]propyl}[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
1-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]-4-{3-[(propan-2-yl)oxy]propyl}[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Compound characteristics
| Compound ID: | C741-1158 |
| Compound Name: | 1-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]-4-{3-[(propan-2-yl)oxy]propyl}[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one |
| Molecular Weight: | 502.62 |
| Molecular Formula: | C28 H34 N6 O3 |
| Smiles: | CC(C)OCCCN1C(c2ccccc2n2c(CCC(N3CCN(CC3)c3ccccc3)=O)nnc12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1937 |
| logD: | 2.1937 |
| logSw: | -2.7807 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 66.81 |
| InChI Key: | SYHKFSSEUHRCKM-UHFFFAOYSA-N |