2-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-4,8-dimethyl[1,2,4]triazino[4,5-a]indol-1(2H)-one
Chemical Structure Depiction of
2-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-4,8-dimethyl[1,2,4]triazino[4,5-a]indol-1(2H)-one
2-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-4,8-dimethyl[1,2,4]triazino[4,5-a]indol-1(2H)-one
Compound characteristics
| Compound ID: | C786-1494 |
| Compound Name: | 2-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-4,8-dimethyl[1,2,4]triazino[4,5-a]indol-1(2H)-one |
| Molecular Weight: | 428.53 |
| Molecular Formula: | C26 H28 N4 O2 |
| Smiles: | CC1=NN(CC(N2CCC(CC2)Cc2ccccc2)=O)C(c2cc3cc(C)ccc3n12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4583 |
| logD: | 4.4583 |
| logSw: | -4.4804 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.497 |
| InChI Key: | ZJSUIZLVVROKNM-UHFFFAOYSA-N |