N-(4-fluorophenyl)-N-{[5-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]methyl}methanesulfonamide
					Chemical Structure Depiction of
N-(4-fluorophenyl)-N-{[5-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]methyl}methanesulfonamide
			N-(4-fluorophenyl)-N-{[5-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]methyl}methanesulfonamide
Compound characteristics
| Compound ID: | D580-0672 | 
| Compound Name: | N-(4-fluorophenyl)-N-{[5-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]methyl}methanesulfonamide | 
| Molecular Weight: | 467.58 | 
| Molecular Formula: | C20 H26 F N5 O3 S2 | 
| Smiles: | CS(N(Cc1nnc(n1CC=C)SCC(N1CCCCC1)=O)c1ccc(cc1)F)(=O)=O | 
| Stereo: | ACHIRAL | 
| logP: | 2.0699 | 
| logD: | 2.0699 | 
| logSw: | -2.4721 | 
| Hydrogen bond acceptors count: | 9 | 
| Polar surface area: | 73.177 | 
| InChI Key: | DGUOXZLLOOKJQE-UHFFFAOYSA-N | 
 
				 
				