N-[rel-(1R,2S)-2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)cyclopentyl]-6-methoxypyridine-3-carboxamide
Chemical Structure Depiction of
N-[rel-(1R,2S)-2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)cyclopentyl]-6-methoxypyridine-3-carboxamide
N-[rel-(1R,2S)-2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)cyclopentyl]-6-methoxypyridine-3-carboxamide
Compound characteristics
Compound ID: | CM2661-3833 |
Compound Name: | N-[rel-(1R,2S)-2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)cyclopentyl]-6-methoxypyridine-3-carboxamide |
Molecular Weight: | 379.46 |
Molecular Formula: | C22 H25 N3 O3 |
Smiles: | COc1ccc(cn1)C(N[C@@H]1CCC[C@@H]1C(N1CCc2ccccc2C1)=O)=O |
Stereo: | RELATIVE |
logP: | 2.6686 |
logD: | 2.6686 |
logSw: | -3.0097 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.025 |
InChI Key: | VZEOMLWRSYAGRQ-MOPGFXCFSA-N |