N,2-dicyclopentyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N,2-dicyclopentyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
N,2-dicyclopentyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
Compound ID: | E456-1220 |
Compound Name: | N,2-dicyclopentyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
Molecular Weight: | 408.56 |
Molecular Formula: | C24 H28 N2 O2 S |
Smiles: | C1CCC(C1)NC(C1C(c2cccs2)N(C2CCCC2)C(c2ccccc12)=O)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 4.3325 |
logD: | 4.3325 |
logSw: | -4.4154 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 40.762 |
InChI Key: | PKKZSAOCHDUMKM-UHFFFAOYSA-N |