2-{[5-(2-phenylethyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}-N-[4-(trifluoromethoxy)phenyl]acetamide
Chemical Structure Depiction of
2-{[5-(2-phenylethyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}-N-[4-(trifluoromethoxy)phenyl]acetamide
2-{[5-(2-phenylethyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}-N-[4-(trifluoromethoxy)phenyl]acetamide
Compound characteristics
| Compound ID: | 8010-6015 |
| Compound Name: | 2-{[5-(2-phenylethyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}-N-[4-(trifluoromethoxy)phenyl]acetamide |
| Molecular Weight: | 523.54 |
| Molecular Formula: | C26 H20 F3 N5 O2 S |
| Smiles: | C(Cn1c2ccccc2c2c1nc(nn2)SCC(Nc1ccc(cc1)OC(F)(F)F)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.2165 |
| logD: | 6.2165 |
| logSw: | -6.0984 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.771 |
| InChI Key: | NRXDOUYJJSBLJI-UHFFFAOYSA-N |