1-[3-(4-benzylpiperidin-1-yl)-3-oxopropyl]-4-(2-phenylethyl)[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Chemical Structure Depiction of
1-[3-(4-benzylpiperidin-1-yl)-3-oxopropyl]-4-(2-phenylethyl)[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
1-[3-(4-benzylpiperidin-1-yl)-3-oxopropyl]-4-(2-phenylethyl)[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Compound characteristics
| Compound ID: | C741-0794 |
| Compound Name: | 1-[3-(4-benzylpiperidin-1-yl)-3-oxopropyl]-4-(2-phenylethyl)[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one |
| Molecular Weight: | 519.65 |
| Molecular Formula: | C32 H33 N5 O2 |
| Smiles: | C1CN(CCC1Cc1ccccc1)C(CCc1nnc2N(CCc3ccccc3)C(c3ccccc3n12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5622 |
| logD: | 4.5622 |
| logSw: | -4.6128 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.806 |
| InChI Key: | LKWLWUZIABQLJR-UHFFFAOYSA-N |