2-[4-(ethoxycarbonyl)piperazin-1-yl]-5-[(thiophene-2-sulfonyl)amino]benzoic acid
Chemical Structure Depiction of
2-[4-(ethoxycarbonyl)piperazin-1-yl]-5-[(thiophene-2-sulfonyl)amino]benzoic acid
2-[4-(ethoxycarbonyl)piperazin-1-yl]-5-[(thiophene-2-sulfonyl)amino]benzoic acid
Compound characteristics
Compound ID: | F290-0207 |
Compound Name: | 2-[4-(ethoxycarbonyl)piperazin-1-yl]-5-[(thiophene-2-sulfonyl)amino]benzoic acid |
Molecular Weight: | 439.51 |
Molecular Formula: | C18 H21 N3 O6 S2 |
Smiles: | CCOC(N1CCN(CC1)c1ccc(cc1C(O)=O)NS(c1cccs1)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.0666 |
logD: | 0.951 |
logSw: | -3.4808 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 96.246 |
InChI Key: | RDNTYZLEBXPDCH-UHFFFAOYSA-N |