2-{[4-(4-bromophenyl)-5-(2,3-dimethyl-1H-indol-5-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(1H-indol-3-yl)ethan-1-one
					Chemical Structure Depiction of
2-{[4-(4-bromophenyl)-5-(2,3-dimethyl-1H-indol-5-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(1H-indol-3-yl)ethan-1-one
			2-{[4-(4-bromophenyl)-5-(2,3-dimethyl-1H-indol-5-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(1H-indol-3-yl)ethan-1-one
Compound characteristics
| Compound ID: | K822-0286 | 
| Compound Name: | 2-{[4-(4-bromophenyl)-5-(2,3-dimethyl-1H-indol-5-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(1H-indol-3-yl)ethan-1-one | 
| Molecular Weight: | 556.48 | 
| Molecular Formula: | C28 H22 Br N5 O S | 
| Smiles: | Cc1c2cc(ccc2[nH]c1C)c1nnc(n1c1ccc(cc1)[Br])SCC(c1c[nH]c2ccccc12)=O | 
| Stereo: | ACHIRAL | 
| logP: | 7.0229 | 
| logD: | 7.0229 | 
| logSw: | -5.7722 | 
| Hydrogen bond acceptors count: | 5 | 
| Hydrogen bond donors count: | 2 | 
| Polar surface area: | 57.756 | 
| InChI Key: | CBPAFEDQNMZLEF-UHFFFAOYSA-N | 
 
				 
				