N-{2-[cyclohexyl(methyl)amino]ethyl}-2-(9-methoxy-4-methyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
Chemical Structure Depiction of
N-{2-[cyclohexyl(methyl)amino]ethyl}-2-(9-methoxy-4-methyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
N-{2-[cyclohexyl(methyl)amino]ethyl}-2-(9-methoxy-4-methyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
Compound characteristics
| Compound ID: | C786-2563 |
| Compound Name: | N-{2-[cyclohexyl(methyl)amino]ethyl}-2-(9-methoxy-4-methyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide |
| Molecular Weight: | 425.53 |
| Molecular Formula: | C23 H31 N5 O3 |
| Smiles: | CC1=NN(CC(NCCN(C)C2CCCCC2)=O)C(c2cc3c(cccc3n12)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3917 |
| logD: | 0.9506 |
| logSw: | -2.8758 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.357 |
| InChI Key: | VHQOOEDKQIZAGL-UHFFFAOYSA-N |