2-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-9-methoxy-4-methyl[1,2,4]triazino[4,5-a]indol-1(2H)-one
Chemical Structure Depiction of
2-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-9-methoxy-4-methyl[1,2,4]triazino[4,5-a]indol-1(2H)-one
2-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-9-methoxy-4-methyl[1,2,4]triazino[4,5-a]indol-1(2H)-one
Compound characteristics
| Compound ID: | C786-2641 |
| Compound Name: | 2-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-9-methoxy-4-methyl[1,2,4]triazino[4,5-a]indol-1(2H)-one |
| Molecular Weight: | 444.53 |
| Molecular Formula: | C26 H28 N4 O3 |
| Smiles: | CC1=NN(CC(N2CCC(CC2)Cc2ccccc2)=O)C(c2cc3c(cccc3n12)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9724 |
| logD: | 3.9724 |
| logSw: | -4.2593 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.127 |
| InChI Key: | DQSRROXOFDYRER-UHFFFAOYSA-N |