Name: Name:4-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxobut-2-enoic acid
Brand: Angene
SKU: AG019VYP
Rating: 90 (10 reviews)

4-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxobut-2-enoic acid

CAS No.:

904796-26-5

Catalog Number:

AG019VYP

Molecular Formula:

C15H18N2O4

Molecular Weight:

290.3144

Catalog Number:

AG019VYP

Chemical Name:

4-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxobut-2-enoic acid

CAS Number:

904796-26-5

Molecular Formula:

C15H18N2O4

Molecular Weight:

290.3144

MDL Number:

MFCD06065937

IUPAC Name:

4-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxobut-2-enoic acid

InChI:

InChI=1S/C15H18N2O4/c1-21-13-4-2-12(3-5-13)16-8-10-17(11-9-16)14(18)6-7-15(19)20/h2-7H,8-11H2,1H3,(H,19,20)

InChI Key:

UYTIHOJKTPMTAM-UHFFFAOYSA-N

SMILES:

COc1ccc(cc1)N1CCN(CC1)C(=O)C=CC(=O)O

Complexity:

395

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

290.127g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

290.319g/mol

Monoisotopic Mass:

290.127g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

70.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.1