5-{4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl}-2-[(ethanesulfonyl)amino]benzoic acid--trifluoroacetic acid (1/1)
					Chemical Structure Depiction of
5-{4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl}-2-[(ethanesulfonyl)amino]benzoic acid--trifluoroacetic acid (1/1)
			5-{4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl}-2-[(ethanesulfonyl)amino]benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F684-0152 | 
| Compound Name: | 5-{4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl}-2-[(ethanesulfonyl)amino]benzoic acid--trifluoroacetic acid (1/1) | 
| Molecular Weight: | 512.5 | 
| Molecular Formula: | C17 H26 N4 O5 S | 
| Salt: | CF3COOH | 
| Smiles: | CCS(Nc1ccc(cc1C(O)=O)N1CCN(CC1)CC(N(C)C)=O)(=O)=O | 
| Stereo: | ACHIRAL | 
| logP: | 0.0455 | 
| logD: | -4.126 | 
| logSw: | -2.4468 | 
| Hydrogen bond acceptors count: | 10 | 
| Hydrogen bond donors count: | 2 | 
| Polar surface area: | 93.235 | 
| InChI Key: | XSQAOOJLIAVSEG-UHFFFAOYSA-N | 
 
				 
				