4-(5-cyclopentyl-1,2,4-oxadiazol-3-yl)-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]benzamide
Chemical Structure Depiction of
4-(5-cyclopentyl-1,2,4-oxadiazol-3-yl)-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]benzamide
4-(5-cyclopentyl-1,2,4-oxadiazol-3-yl)-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]benzamide
Compound characteristics
Compound ID: | F628-1658 |
Compound Name: | 4-(5-cyclopentyl-1,2,4-oxadiazol-3-yl)-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]benzamide |
Molecular Weight: | 430.51 |
Molecular Formula: | C25 H26 N4 O3 |
Smiles: | C1CCC(C1)c1nc(c2ccc(cc2)C(NCC(N2CCc3ccccc3C2)=O)=O)no1 |
Stereo: | ACHIRAL |
logP: | 4.8028 |
logD: | 4.8027 |
logSw: | -4.7402 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 72.67 |
InChI Key: | QQHLNPOXDRLXIR-UHFFFAOYSA-N |