1-(4-{3-fluoro-4-[(6-methoxy-1H-1,3-benzodiazol-2-yl)methoxy]pyrrolidin-1-yl}piperidin-1-yl)ethan-1-one

AlkaPlorer ID: AK530267

Synonym: None

IUPAC Name: 1-[4-[3-fluoro-4-[(6-methoxy-1H-benzimidazol-2-yl)methoxy]pyrrolidin-1-yl]piperidin-1-yl]ethanone

Structure

SMILES: COC1=CC=C2N=C(COC3CN(C4CCN(C(C)=O)CC4)CC3F)NC2=C1

copy

InChI: InChI=1S/C20H27FN4O3/c1-13(26)24-7-5-14(6-8-24)25-10-16(21)19(11-25)28-12-20-22-17-4-3-15(27-2)9-18(17)23-20/h3-4,9,14,16,19H,5-8,10-12H2,1-2H3,(H,22,23)

copy

InChIKey: TUVPYMCJCVCFHQ-UHFFFAOYSA-N

copy

Reference

Marine natural products

PubChem CID: 162809979

COCONUT: CNP0055695.1

Source

Species Genus Family Order Class Phylum Kingdom Domain

Properties Information

Molecule Weight: 390.4590000000002

TPSA: 70.69

MolLogP: 2.1213

Number of H-Donors: 1

Number of H-Acceptors: 5

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information