2-{2-[4-(2,3-dimethylphenyl)piperazin-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-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-9-methoxy-4-methyl[1,2,4]triazino[4,5-a]indol-1(2H)-one
2-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-9-methoxy-4-methyl[1,2,4]triazino[4,5-a]indol-1(2H)-one
Compound characteristics
| Compound ID: | C786-2626 |
| Compound Name: | 2-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-9-methoxy-4-methyl[1,2,4]triazino[4,5-a]indol-1(2H)-one |
| Molecular Weight: | 459.55 |
| Molecular Formula: | C26 H29 N5 O3 |
| Smiles: | CC1=NN(CC(N2CCN(CC2)c2cccc(C)c2C)=O)C(c2cc3c(cccc3n12)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7605 |
| logD: | 3.7604 |
| logSw: | -4.039 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.358 |
| InChI Key: | ZGTOAPWBUFWVIK-UHFFFAOYSA-N |