2-{[5-(4-methyl-4H-furo[3,2-b]pyrrol-5-yl)-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methylphenyl)butanamide
Chemical Structure Depiction of
2-{[5-(4-methyl-4H-furo[3,2-b]pyrrol-5-yl)-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methylphenyl)butanamide
2-{[5-(4-methyl-4H-furo[3,2-b]pyrrol-5-yl)-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methylphenyl)butanamide
Compound characteristics
| Compound ID: | E634-1470 |
| Compound Name: | 2-{[5-(4-methyl-4H-furo[3,2-b]pyrrol-5-yl)-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methylphenyl)butanamide |
| Molecular Weight: | 485.61 |
| Molecular Formula: | C27 H27 N5 O2 S |
| Smiles: | CCC(C(Nc1ccc(C)cc1)=O)Sc1nnc(c2cc3c(cco3)n2C)n1c1ccccc1C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7573 |
| logD: | 5.7573 |
| logSw: | -5.3809 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.782 |
| InChI Key: | OENCHOGAPXKWQE-DEOSSOPVSA-N |