N-{3-[ethyl(3-methylphenyl)amino]propyl}-2-(9-methoxy-4-methyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
Chemical Structure Depiction of
N-{3-[ethyl(3-methylphenyl)amino]propyl}-2-(9-methoxy-4-methyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
N-{3-[ethyl(3-methylphenyl)amino]propyl}-2-(9-methoxy-4-methyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
Compound characteristics
| Compound ID: | C786-2534 |
| Compound Name: | N-{3-[ethyl(3-methylphenyl)amino]propyl}-2-(9-methoxy-4-methyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide |
| Molecular Weight: | 461.56 |
| Molecular Formula: | C26 H31 N5 O3 |
| Smiles: | CCN(CCCNC(CN1C(c2cc3c(cccc3n2C(C)=N1)OC)=O)=O)c1cccc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.6196 |
| logD: | 3.5873 |
| logSw: | -3.6847 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.309 |
| InChI Key: | QOFXGABXXNTSJC-UHFFFAOYSA-N |