9-methoxy-4-methyl-2-(2-oxo-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)[1,2,4]triazino[4,5-a]indol-1(2H)-one
Chemical Structure Depiction of
9-methoxy-4-methyl-2-(2-oxo-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)[1,2,4]triazino[4,5-a]indol-1(2H)-one
9-methoxy-4-methyl-2-(2-oxo-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)[1,2,4]triazino[4,5-a]indol-1(2H)-one
Compound characteristics
| Compound ID: | C786-2642 |
| Compound Name: | 9-methoxy-4-methyl-2-(2-oxo-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)[1,2,4]triazino[4,5-a]indol-1(2H)-one |
| Molecular Weight: | 499.49 |
| Molecular Formula: | C25 H24 F3 N5 O3 |
| Smiles: | CC1=NN(CC(N2CCN(CC2)c2cccc(c2)C(F)(F)F)=O)C(c2cc3c(cccc3n12)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4376 |
| logD: | 3.4376 |
| logSw: | -3.7643 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.659 |
| InChI Key: | HTYZLXNEDSNMAQ-UHFFFAOYSA-N |