2-(4-ethylpiperazin-1-yl)-5-[(5-fluoro-2-methylbenzene-1-sulfonyl)amino]benzoic acid
Chemical Structure Depiction of
2-(4-ethylpiperazin-1-yl)-5-[(5-fluoro-2-methylbenzene-1-sulfonyl)amino]benzoic acid
2-(4-ethylpiperazin-1-yl)-5-[(5-fluoro-2-methylbenzene-1-sulfonyl)amino]benzoic acid
Compound characteristics
Compound ID: | F290-0143 |
Compound Name: | 2-(4-ethylpiperazin-1-yl)-5-[(5-fluoro-2-methylbenzene-1-sulfonyl)amino]benzoic acid |
Molecular Weight: | 421.49 |
Molecular Formula: | C20 H24 F N3 O4 S |
Smiles: | CCN1CCN(CC1)c1ccc(cc1C(O)=O)NS(c1cc(ccc1C)F)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.3313 |
logD: | 3.3313 |
logSw: | -3.5574 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 75.984 |
InChI Key: | NYOATDHWMXEIJS-UHFFFAOYSA-N |