2-(dipropylamino)-5-[(2,4,6-trimethylbenzene-1-sulfonyl)amino]benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
2-(dipropylamino)-5-[(2,4,6-trimethylbenzene-1-sulfonyl)amino]benzoic acid--trifluoroacetic acid (1/1)
2-(dipropylamino)-5-[(2,4,6-trimethylbenzene-1-sulfonyl)amino]benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
Compound ID: | F294-0238 |
Compound Name: | 2-(dipropylamino)-5-[(2,4,6-trimethylbenzene-1-sulfonyl)amino]benzoic acid--trifluoroacetic acid (1/1) |
Molecular Weight: | 532.58 |
Molecular Formula: | C22 H30 N2 O4 S |
Salt: | CF3COOH |
Smiles: | CCCN(CCC)c1ccc(cc1C(O)=O)NS(c1c(C)cc(C)cc1C)(=O)=O |
Stereo: | ACHIRAL |
logP: | 5.9769 |
logD: | 3.8613 |
logSw: | -5.3262 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 72.239 |
InChI Key: | SODCTGMZRDBRBZ-UHFFFAOYSA-N |