Name: Name:Benzamide, N-[(1Z)-2-(2-bromophenyl)-2-chloro-1-(1-piperidinylcarbonyl)ethenyl]-
Brand: Angene
SKU: AG0021LO
Rating: 90 (10 reviews)

Benzamide, N-[(1Z)-2-(2-bromophenyl)-2-chloro-1-(1-piperidinylcarbonyl)ethenyl]-

CAS No.:

1800044-77-2

Catalog Number:

AG0021LO

Molecular Formula:

C21H20BrClN2O2

Molecular Weight:

447.7527

Catalog Number:

AG0021LO

Chemical Name:

Benzamide, N-[(1Z)-2-(2-bromophenyl)-2-chloro-1-(1-piperidinylcarbonyl)ethenyl]-

CAS Number:

1800044-77-2

Molecular Formula:

C21H20BrClN2O2

Molecular Weight:

447.7527

MDL Number:

MFCD29037407

IUPAC Name:

N-[(Z)-1-(2-bromophenyl)-1-chloro-3-oxo-3-piperidin-1-ylprop-1-en-2-yl]benzamide

InChI:

InChI=1S/C21H20BrClN2O2/c22-17-12-6-5-11-16(17)18(23)19(21(27)25-13-7-2-8-14-25)24-20(26)15-9-3-1-4-10-15/h1,3-6,9-12H,2,7-8,13-14H2,(H,24,26)/b19-18-

InChI Key:

NDXLGXNRLZWHSZ-HNENSFHCSA-N

SMILES:

O=C(c1ccccc1)N/C(=C(/c1ccccc1Br)\Cl)/C(=O)N1CCCCC1

Complexity:

569

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

446.04g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

447.757g/mol

Monoisotopic Mass:

446.04g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

49.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.8