AC1LPOZU structure

AC1LPOZU

(E)-3-(2-chloro-6-fluorophenyl)-1-[4-[(E)-3-(2-chloro-6-fluorophenyl)prop-2-enoyl]-1,4-diazepan-1-yl]prop-2-en-1-one

Also Known As: (E)-3-(2-chloro-6-fluorophenyl)-1-[4-[(E)-3-(2-chloro-6-fluorophenyl)prop-2-enoyl]-1,4-diazepan-1-yl]prop-2-en-1-one|(2E,2'E)-1,1'-(1,4-diazepane-1,4-diyl)bis[3-(2-chloro-6-fluorophenyl)prop-2-en-1-one]|(2E)-1-{4-[(2E)-3-(2-chloro-6-fluorophenyl)prop-2-enoyl](1,4-diazaperhydroepin yl)}-3-(6-chloro-2-fluorophenyl)prop-2-en-1-one

CAS: 547749-62-2
Molecular Formula C23H20Cl2F2N2O2
Molecular Weight 464.08698 g/mol
LogP 5.0591
Topological Polar Surface Area 40.62 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 2
Rotatable Bonds 4
Exact Mass 464.08698
Monoisotopic Mass 464.08698
Heavy Atoms 31
Complexity 918.2317

Chemical Identifiers

CAS Number 547749-62-2
SMILES C1CN(CCN(C1)C(=O)/C=C/C2=C(C=CC=C2Cl)F)C(=O)/C=C/C3=C(C=CC=C3Cl)F

Product Overview

AC1LPOZU (CAS 547749-62-2), with molecular formula C23H20Cl2F2N2O2 and molecular weight 464.08698 g/mol. IUPAC: (E)-3-(2-chloro-6-fluorophenyl)-1-[4-[(E)-3-(2-chloro-6-fluorophenyl)prop-2-enoyl]-1,4-diazepan-1-yl]prop-2-en-1-one.

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