Name: Name:1-Piperazineaceticacid, 4-[(1,1-dimethylethoxy)carbonyl]-a-[(1E)-2-phenylethenyl]-
Brand: Angene
SKU: AG004OXS
Rating: 90 (10 reviews)

1-Piperazineaceticacid, 4-[(1,1-dimethylethoxy)carbonyl]-a-[(1E)-2-phenylethenyl]-

CAS No.:

853681-16-0

Catalog Number:

AG004OXS

Molecular Formula:

C19H26N2O4

Molecular Weight:

346.4207

Catalog Number:

AG004OXS

Chemical Name:

1-Piperazineaceticacid, 4-[(1,1-dimethylethoxy)carbonyl]-a-[(1E)-2-phenylethenyl]-

CAS Number:

853681-16-0

Molecular Formula:

C19H26N2O4

Molecular Weight:

346.4207

MDL Number:

MFCD01862503

IUPAC Name:

(E)-2-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-4-phenylbut-3-enoic acid

InChI:

InChI=1S/C19H26N2O4/c1-19(2,3)25-18(24)21-13-11-20(12-14-21)16(17(22)23)10-9-15-7-5-4-6-8-15/h4-10,16H,11-14H2,1-3H3,(H,22,23)/b10-9+

InChI Key:

SJGWOAUBXYMANH-MDZDMXLPSA-N

SMILES:

OC(=O)C(N1CCN(CC1)C(=O)OC(C)(C)C)/C=C/c1ccccc1

Complexity:

484

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

346.189g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

346.427g/mol

Monoisotopic Mass:

346.189g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

70.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.6