5-(2-phenylethyl)-3-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-5H-[1,2,4]triazino[5,6-b]indole
Chemical Structure Depiction of
5-(2-phenylethyl)-3-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-5H-[1,2,4]triazino[5,6-b]indole
5-(2-phenylethyl)-3-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-5H-[1,2,4]triazino[5,6-b]indole
Compound characteristics
| Compound ID: | 8016-0888 |
| Compound Name: | 5-(2-phenylethyl)-3-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-5H-[1,2,4]triazino[5,6-b]indole |
| Molecular Weight: | 464.51 |
| Molecular Formula: | C25 H19 F3 N4 S |
| Smiles: | C(Cn1c2ccccc2c2c1nc(nn2)SCc1cccc(c1)C(F)(F)F)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.3842 |
| logD: | 6.3842 |
| logSw: | -6.6944 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.685 |
| InChI Key: | HIHCYAQKAXAAKV-UHFFFAOYSA-N |