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123885-92-7 | Benzenecarboximidamide, 4,4'-(1,4-piperazinediyl)bis-
CAS No: 123885-92-7 Catalog No: AG000L73 MDL No:
Product Description
Catalog Number:
AG000L73
Chemical Name:
Benzenecarboximidamide, 4,4'-(1,4-piperazinediyl)bis-
CAS Number:
123885-92-7
Molecular Formula:
C18H22N6
Molecular Weight:
322.4075
IUPAC Name:
4-[4-(4-carbamimidoylphenyl)piperazin-1-yl]benzenecarboximidamide
InChI:
InChI=1S/C18H22N6/c19-17(20)13-1-5-15(6-2-13)23-9-11-24(12-10-23)16-7-3-14(4-8-16)18(21)22/h1-8H,9-12H2,(H3,19,20)(H3,21,22)
InChI Key:
GFDIGDWACCJVOI-UHFFFAOYSA-N
SMILES:
NC(=N)c1ccc(cc1)N1CCN(CC1)c1ccc(cc1)C(=N)N
Properties
Complexity:
398
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
322.191g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
322.416g/mol
Monoisotopic Mass:
322.191g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Literature
| Title | Journal |
|---|---|
| 1,4-diarylpiperazines and analogs as anti-tubercular agents: synthesis and biological evaluation. | European journal of medicinal chemistry 20120301 |
| 1,2-ethane bis-1-amino-4-benzamidine is active against several brain insult and seizure challenges through anti-NMDA mechanisms targeting the 3H-TCP binding site and antioxidant action. | European journal of medicinal chemistry 20100701 |
| Bisbenzamidines as antifungal agents. are both amidine functions required to observe an anti-Pneumocystis carinii activity? | Molecules (Basel, Switzerland) 20100611 |
| DNA binding affinity of bisguanidine and bis(2-aminoimidazoline) derivatives with in vivo antitrypanosomal activity. | Journal of medicinal chemistry 20060615 |
| Highly active anti-Pneumocystis carinii compounds in a library of novel piperazine-linked bisbenzamidines and related compounds. | Antimicrobial agents and chemotherapy 20041101 |
| Trypanocidal activity of conformationally restricted pentamidine congeners. | Journal of medicinal chemistry 20030313 |
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