3-(1,3-benzothiazol-2-yl)-7-hydroxy-8-[(2-methylpiperidin-1-yl)methyl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(1,3-benzothiazol-2-yl)-7-hydroxy-8-[(2-methylpiperidin-1-yl)methyl]-2H-1-benzopyran-2-one
3-(1,3-benzothiazol-2-yl)-7-hydroxy-8-[(2-methylpiperidin-1-yl)methyl]-2H-1-benzopyran-2-one
Compound characteristics
Compound ID: | 3570-0021 |
Compound Name: | 3-(1,3-benzothiazol-2-yl)-7-hydroxy-8-[(2-methylpiperidin-1-yl)methyl]-2H-1-benzopyran-2-one |
Molecular Weight: | 406.5 |
Molecular Formula: | C23 H22 N2 O3 S |
Smiles: | CC1CCCCN1Cc1c(ccc2C=C(C(=O)Oc12)c1nc2ccccc2s1)O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.7633 |
logD: | 4.2065 |
logSw: | -4.3221 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 50.025 |
InChI Key: | NLUMALRDFQBAAL-AWEZNQCLSA-N |