ethyl 4-[(6-hydroxy-2-oxo-7-phenyl-2H-1-benzopyran-4-yl)methyl]piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[(6-hydroxy-2-oxo-7-phenyl-2H-1-benzopyran-4-yl)methyl]piperazine-1-carboxylate
ethyl 4-[(6-hydroxy-2-oxo-7-phenyl-2H-1-benzopyran-4-yl)methyl]piperazine-1-carboxylate
Compound characteristics
Compound ID: | Y041-4042 |
Compound Name: | ethyl 4-[(6-hydroxy-2-oxo-7-phenyl-2H-1-benzopyran-4-yl)methyl]piperazine-1-carboxylate |
Molecular Weight: | 408.45 |
Molecular Formula: | C23 H24 N2 O5 |
Smiles: | CCOC(N1CCN(CC1)CC1=CC(=O)Oc2cc(c3ccccc3)c(cc12)O)=O |
Stereo: | ACHIRAL |
logP: | 3.7362 |
logD: | 3.7301 |
logSw: | -3.5466 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.435 |
InChI Key: | ARXJJTDXXSSQTQ-UHFFFAOYSA-N |