N-(3-methoxyphenyl)-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-(3-methoxyphenyl)-2-({2-[2-(2-methyl-1H-benzimidazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)butanamide
N-(3-methoxyphenyl)-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: | K280-0411 |
| Compound Name: | N-(3-methoxyphenyl)-2-({2-[2-(2-methyl-1H-benzimidazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)butanamide |
| Molecular Weight: | 551.67 |
| Molecular Formula: | C30 H29 N7 O2 S |
| Smiles: | CCC(C(Nc1cccc(c1)OC)=O)Sc1nc2ccccc2c2nc(CCn3c4ccccc4nc3C)nn12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8414 |
| logD: | 5.726 |
| logSw: | -5.7072 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.65 |
| InChI Key: | XWIMKFALSJILEB-SANMLTNESA-N |