3-(4-methyl-5-{[(4-nitrophenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)-1H-indole
Chemical Structure Depiction of
3-(4-methyl-5-{[(4-nitrophenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)-1H-indole
3-(4-methyl-5-{[(4-nitrophenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)-1H-indole
Compound characteristics
| Compound ID: | G856-2685 |
| Compound Name: | 3-(4-methyl-5-{[(4-nitrophenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)-1H-indole |
| Molecular Weight: | 365.41 |
| Molecular Formula: | C18 H15 N5 O2 S |
| Smiles: | Cn1c(c2c[nH]c3ccccc23)nnc1SCc1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.5954 |
| logD: | 3.5954 |
| logSw: | -3.8571 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.303 |
| InChI Key: | UGKSQHJXVGKZMZ-UHFFFAOYSA-N |