2-[(5-benzyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-[4-(trifluoromethoxy)phenyl]butanamide
Chemical Structure Depiction of
2-[(5-benzyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-[4-(trifluoromethoxy)phenyl]butanamide
2-[(5-benzyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-[4-(trifluoromethoxy)phenyl]butanamide
Compound characteristics
| Compound ID: | 8009-8381 |
| Compound Name: | 2-[(5-benzyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-[4-(trifluoromethoxy)phenyl]butanamide |
| Molecular Weight: | 537.56 |
| Molecular Formula: | C27 H22 F3 N5 O2 S |
| Smiles: | CCC(C(Nc1ccc(cc1)OC(F)(F)F)=O)Sc1nc2c(c3ccccc3n2Cc2ccccc2)nn1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.0162 |
| logD: | 7.0162 |
| logSw: | -5.9649 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.006 |
| InChI Key: | VZPCIDVUYKIACC-QFIPXVFZSA-N |