Name: Name:2-(4-Benzylpiperazino)-5-fluorobenzoic acid
Brand: Angene
SKU: AG000OB1
Rating: 90 (10 reviews)

2-(4-Benzylpiperazino)-5-fluorobenzoic acid

CAS No.:

1256633-38-1

Catalog Number:

AG000OB1

Molecular Formula:

C18H19FN2O2

Molecular Weight:

314.3541

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Catalog Number:

AG000OB1

Chemical Name:

2-(4-Benzylpiperazino)-5-fluorobenzoic acid

CAS Number:

1256633-38-1

Molecular Formula:

C18H19FN2O2

Molecular Weight:

314.3541

MDL Number:

MFCD18070991

IUPAC Name:

2-(4-benzylpiperazin-1-yl)-5-fluorobenzoic acid

InChI:

InChI=1S/C18H19FN2O2/c19-15-6-7-17(16(12-15)18(22)23)21-10-8-20(9-11-21)13-14-4-2-1-3-5-14/h1-7,12H,8-11,13H2,(H,22,23)

InChI Key:

ULOYDKUTNHOZGG-UHFFFAOYSA-N

SMILES:

Fc1ccc(c(c1)C(=O)O)N1CCN(CC1)Cc1ccccc1

Complexity:

393

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

314.143g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

314.36g/mol

Monoisotopic Mass:

314.143g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

43.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.7