7-methyl-4-oxo-N-[2-(pyrrolidin-1-yl)-2-(thiophen-2-yl)ethyl]-4H-1-benzopyran-2-carboxamide
Chemical Structure Depiction of
7-methyl-4-oxo-N-[2-(pyrrolidin-1-yl)-2-(thiophen-2-yl)ethyl]-4H-1-benzopyran-2-carboxamide
7-methyl-4-oxo-N-[2-(pyrrolidin-1-yl)-2-(thiophen-2-yl)ethyl]-4H-1-benzopyran-2-carboxamide
Compound characteristics
Compound ID: | D491-2167 |
Compound Name: | 7-methyl-4-oxo-N-[2-(pyrrolidin-1-yl)-2-(thiophen-2-yl)ethyl]-4H-1-benzopyran-2-carboxamide |
Molecular Weight: | 382.48 |
Molecular Formula: | C21 H22 N2 O3 S |
Smiles: | [H]N(CC(c1cccs1)N1CCCC1)C(C1=CC(c2ccc(C)cc2O1)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.3105 |
logD: | 2.6061 |
logSw: | -3.7407 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 50.844 |
InChI Key: | LSGCSDZPJTXHPK-INIZCTEOSA-N |