2-[(5-benzyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(4-phenyl-1,3-thiazol-2-yl)butanamide
Chemical Structure Depiction of
2-[(5-benzyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(4-phenyl-1,3-thiazol-2-yl)butanamide
2-[(5-benzyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(4-phenyl-1,3-thiazol-2-yl)butanamide
Compound characteristics
Compound ID: | 6623-1383 |
Compound Name: | 2-[(5-benzyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(4-phenyl-1,3-thiazol-2-yl)butanamide |
Molecular Weight: | 536.68 |
Molecular Formula: | C29 H24 N6 O S2 |
Smiles: | CCC(C(Nc1nc(cs1)c1ccccc1)=O)Sc1nc2c(c3ccccc3n2Cc2ccccc2)nn1 |
Stereo: | RACEMIC MIXTURE |
logP: | 7.4161 |
logD: | 7.416 |
logSw: | -5.9685 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 65.844 |
InChI Key: | UPPRURGIZUWIGA-DEOSSOPVSA-N |