4-ethyl-2-[(4-fluorophenyl)methyl]-8-methyl[1,2,4]triazino[4,5-a]indol-1(2H)-one
Chemical Structure Depiction of
4-ethyl-2-[(4-fluorophenyl)methyl]-8-methyl[1,2,4]triazino[4,5-a]indol-1(2H)-one
4-ethyl-2-[(4-fluorophenyl)methyl]-8-methyl[1,2,4]triazino[4,5-a]indol-1(2H)-one
Compound characteristics
| Compound ID: | C888-0618 |
| Compound Name: | 4-ethyl-2-[(4-fluorophenyl)methyl]-8-methyl[1,2,4]triazino[4,5-a]indol-1(2H)-one |
| Molecular Weight: | 335.38 |
| Molecular Formula: | C20 H18 F N3 O |
| Smiles: | CCC1=NN(Cc2ccc(cc2)F)C(c2cc3cc(C)ccc3n12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3253 |
| logD: | 4.3172 |
| logSw: | -4.3023 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 30.4676 |
| InChI Key: | VFSVTSXVPMBTPY-UHFFFAOYSA-N |