3-[(ethanesulfonyl)amino]-4-{4-[2-(4-fluoroanilino)-2-oxoethyl]piperazin-1-yl}benzoic acid--trifluoroacetic acid (1/1)
					Chemical Structure Depiction of
3-[(ethanesulfonyl)amino]-4-{4-[2-(4-fluoroanilino)-2-oxoethyl]piperazin-1-yl}benzoic acid--trifluoroacetic acid (1/1)
			3-[(ethanesulfonyl)amino]-4-{4-[2-(4-fluoroanilino)-2-oxoethyl]piperazin-1-yl}benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F292-0698 | 
| Compound Name: | 3-[(ethanesulfonyl)amino]-4-{4-[2-(4-fluoroanilino)-2-oxoethyl]piperazin-1-yl}benzoic acid--trifluoroacetic acid (1/1) | 
| Molecular Weight: | 578.54 | 
| Molecular Formula: | C21 H25 F N4 O5 S | 
| Salt: | CF3COOH | 
| Smiles: | CCS(Nc1cc(ccc1N1CCN(CC1)CC(Nc1ccc(cc1)F)=O)C(O)=O)(=O)=O | 
| Stereo: | ACHIRAL | 
| logP: | 3.3006 | 
| logD: | 1.5401 | 
| logSw: | -3.5886 | 
| Hydrogen bond acceptors count: | 10 | 
| Hydrogen bond donors count: | 3 | 
| Polar surface area: | 100.338 | 
| InChI Key: | NBVVYLFDNLCMLS-UHFFFAOYSA-N | 
 
				 
				