4-(3,5-dimethylpiperidine-1-sulfonyl)-N-[4-(2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]benzamide
Chemical Structure Depiction of
4-(3,5-dimethylpiperidine-1-sulfonyl)-N-[4-(2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]benzamide
4-(3,5-dimethylpiperidine-1-sulfonyl)-N-[4-(2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]benzamide
Compound characteristics
Compound ID: | 3333-4164 |
Compound Name: | 4-(3,5-dimethylpiperidine-1-sulfonyl)-N-[4-(2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-2-yl]benzamide |
Molecular Weight: | 523.63 |
Molecular Formula: | C26 H25 N3 O5 S2 |
Smiles: | CC1CC(C)CN(C1)S(c1ccc(cc1)C(Nc1nc(cs1)C1=Cc2ccccc2OC1=O)=O)(=O)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 5.1311 |
logD: | 4.7445 |
logSw: | -5.0517 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 85.604 |
InChI Key: | VIDOMFLPIPDZTQ-UHFFFAOYSA-N |