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Nsc357775

CAS No.:
31384-83-5
Catalog Number:
AG00C92X
Molecular Formula:
C14H16ClN7
Molecular Weight:
317.7767
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Product Description
Catalog Number:
AG00C92X
Chemical Name:
Nsc357775
CAS Number:
31384-83-5
Molecular Formula:
C14H16ClN7
Molecular Weight:
317.7767
MDL Number:
MFCD31728188
IUPAC Name:
4-[2-(4-carbamimidoylphenyl)iminohydrazinyl]benzenecarboximidamide;dihydrochloride
InChI:
InChI=1S/C14H15N7.2ClH/c15-13(16)9-1-5-11(6-2-9)19-21-20-12-7-3-10(4-8-12)14(17)18;;/h1-8H,(H3,15,16)(H3,17,18)(H,19,20);2*1H
InChI Key:
QTFXIVUZEWTIAR-UHFFFAOYSA-N
SMILES:
NC(=N)c1ccc(cc1)N/N=N/c1ccc(cc1)C(=N)N.Cl
EC Number:
608-612-5
UNII:
V40X8767D1
Properties
Complexity:
390  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
353.092g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
7  
Isotope Atom Count:
0
Molecular Weight:
354.239g/mol
Monoisotopic Mass:
353.092g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
137A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties