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14586-00-6

14586-00-6 | Hydrazinecarboxamide, 2-(4-nitrophenyl)-N-phenyl-

CAS No: 14586-00-6 Catalog No: AG001DHL MDL No:

Product Description

Catalog Number:
AG001DHL
Chemical Name:
Hydrazinecarboxamide, 2-(4-nitrophenyl)-N-phenyl-
CAS Number:
14586-00-6
Molecular Formula:
C13H12N4O3
Molecular Weight:
272.2594
IUPAC Name:
1-(4-nitroanilino)-3-phenylurea
InChI:
InChI=1S/C13H12N4O3/c18-13(14-10-4-2-1-3-5-10)16-15-11-6-8-12(9-7-11)17(19)20/h1-9,15H,(H2,14,16,18)
InChI Key:
LACJWRZIZABXNR-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccccc1)NNc1ccc(cc1)[N+](=O)[O-]

Properties

Complexity:
331  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.091g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
272.264g/mol
Monoisotopic Mass:
272.091g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
99A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  

Literature

Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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