6-bromo-N-[2-(4-methoxyphenyl)-2-(piperidin-1-yl)ethyl]-4-oxo-4H-1-benzopyran-2-carboxamide
Chemical Structure Depiction of
6-bromo-N-[2-(4-methoxyphenyl)-2-(piperidin-1-yl)ethyl]-4-oxo-4H-1-benzopyran-2-carboxamide
6-bromo-N-[2-(4-methoxyphenyl)-2-(piperidin-1-yl)ethyl]-4-oxo-4H-1-benzopyran-2-carboxamide
Compound characteristics
Compound ID: | D491-2304 |
Compound Name: | 6-bromo-N-[2-(4-methoxyphenyl)-2-(piperidin-1-yl)ethyl]-4-oxo-4H-1-benzopyran-2-carboxamide |
Molecular Weight: | 485.38 |
Molecular Formula: | C24 H25 Br N2 O4 |
Smiles: | [H]N(CC(c1ccc(cc1)OC)N1CCCCC1)C(C1=CC(c2cc(ccc2O1)[Br])=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.4236 |
logD: | 4.0684 |
logSw: | -4.3093 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 57.003 |
InChI Key: | XUMXSGPCXLJJCK-FQEVSTJZSA-N |