2-[(3-chlorophenyl)methyl]-4-ethyl-8-methyl[1,2,4]triazino[4,5-a]indol-1(2H)-one
Chemical Structure Depiction of
2-[(3-chlorophenyl)methyl]-4-ethyl-8-methyl[1,2,4]triazino[4,5-a]indol-1(2H)-one
2-[(3-chlorophenyl)methyl]-4-ethyl-8-methyl[1,2,4]triazino[4,5-a]indol-1(2H)-one
Compound characteristics
| Compound ID: | C888-0671 |
| Compound Name: | 2-[(3-chlorophenyl)methyl]-4-ethyl-8-methyl[1,2,4]triazino[4,5-a]indol-1(2H)-one |
| Molecular Weight: | 351.83 |
| Molecular Formula: | C20 H18 Cl N3 O |
| Smiles: | CCC1=NN(Cc2cccc(c2)[Cl])C(c2cc3cc(C)ccc3n12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9517 |
| logD: | 4.9474 |
| logSw: | -4.7792 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 30.4676 |
| InChI Key: | FGPYSESCRRDKNL-UHFFFAOYSA-N |