CAS 16264-05-4 | Piperazine, 1,4-bis(4-nitrophenyl)- | CAS Number 16264-05-4

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16264-05-4 | Piperazine, 1,4-bis(4-nitrophenyl)-

CAS No: 16264-05-4 Catalog No: AG001TAH MDL No:MFCD00156622

Product Description

Catalog Number:

AG001TAH

Chemical Name:

Piperazine, 1,4-bis(4-nitrophenyl)-

CAS Number:

16264-05-4

Molecular Formula:

C16H16N4O4

Molecular Weight:

328.3226

MDL Number:

MFCD00156622

IUPAC Name:

1,4-bis(4-nitrophenyl)piperazine

InChI:

InChI=1S/C16H16N4O4/c21-19(22)15-5-1-13(2-6-15)17-9-11-18(12-10-17)14-3-7-16(8-4-14)20(23)24/h1-8H,9-12H2

InChI Key:

VCZGAOMAWKGNEF-UHFFFAOYSA-N

SMILES:

[O-][N+](=O)c1ccc(cc1)N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-]

EC Number:

240-371-8

NSC Number:

725997

Properties

Complexity:

398

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

328.117g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

328.328g/mol

Monoisotopic Mass:

328.117g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

98.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.3

Literature

Title	Journal
1,4-diarylpiperazines and analogs as anti-tubercular agents: synthesis and biological evaluation.	European journal of medicinal chemistry 20120301
Highly active anti-Pneumocystis carinii compounds in a library of novel piperazine-linked bisbenzamidines and related compounds.	Antimicrobial agents and chemotherapy 20041101