2-[5-nitro-2-(piperidin-1-yl)phenyl]-1,3-thiazolidine-4-carboxylic acid
Chemical Structure Depiction of
2-[5-nitro-2-(piperidin-1-yl)phenyl]-1,3-thiazolidine-4-carboxylic acid
2-[5-nitro-2-(piperidin-1-yl)phenyl]-1,3-thiazolidine-4-carboxylic acid
Compound characteristics
Compound ID: | 8017-2618 |
Compound Name: | 2-[5-nitro-2-(piperidin-1-yl)phenyl]-1,3-thiazolidine-4-carboxylic acid |
Molecular Weight: | 337.4 |
Molecular Formula: | C15 H19 N3 O4 S |
Smiles: | C1CCN(CC1)c1ccc(cc1C1NC(CS1)C(O)=O)[N+]([O-])=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 1.8122 |
logD: | -1.6502 |
logSw: | -2.4315 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 77.146 |
InChI Key: | BMCJYTDGYNXUSC-UHFFFAOYSA-N |