2-{2-[4-(5-chloro-2-methylphenyl)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-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-oxoethyl}-9-methoxy-4-methyl[1,2,4]triazino[4,5-a]indol-1(2H)-one
2-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-oxoethyl}-9-methoxy-4-methyl[1,2,4]triazino[4,5-a]indol-1(2H)-one
Compound characteristics
| Compound ID: | C786-2628 |
| Compound Name: | 2-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-oxoethyl}-9-methoxy-4-methyl[1,2,4]triazino[4,5-a]indol-1(2H)-one |
| Molecular Weight: | 479.97 |
| Molecular Formula: | C25 H26 Cl N5 O3 |
| Smiles: | CC1=NN(CC(N2CCN(CC2)c2cc(ccc2C)[Cl])=O)C(c2cc3c(cccc3n12)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9195 |
| logD: | 3.9195 |
| logSw: | -4.2246 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.358 |
| InChI Key: | XJZULSTUYWZQCE-UHFFFAOYSA-N |