N-cyclohexyl-2-({2-[2-(2-methyl-1H-benzimidazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)butanamide
Chemical Structure Depiction of
N-cyclohexyl-2-({2-[2-(2-methyl-1H-benzimidazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)butanamide
N-cyclohexyl-2-({2-[2-(2-methyl-1H-benzimidazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)butanamide
Compound characteristics
| Compound ID: | K280-0409 |
| Compound Name: | N-cyclohexyl-2-({2-[2-(2-methyl-1H-benzimidazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)butanamide |
| Molecular Weight: | 527.69 |
| Molecular Formula: | C29 H33 N7 O S |
| Smiles: | CCC(C(NC1CCCCC1)=O)Sc1nc2ccccc2c2nc(CCn3c4ccccc4nc3C)nn12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8892 |
| logD: | 5.7738 |
| logSw: | -5.5728 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.153 |
| InChI Key: | ICHCEOIVUZJJKC-VWLOTQADSA-N |