200,000+ products from a single source!
sales@angenechem.com
Home > Imidazoles > 82439-87-0
82439-87-0 | 1H-Imidazole-5-carboxamide,4-hydroxy-1-[(4-nitrophenyl)methyl]-
CAS No: 82439-87-0 Catalog No: AG004WN0 MDL No:
Product Description
Catalog Number:
AG004WN0
Chemical Name:
1H-Imidazole-5-carboxamide,4-hydroxy-1-[(4-nitrophenyl)methyl]-
CAS Number:
82439-87-0
Molecular Formula:
C11H10N4O4
Molecular Weight:
262.2215
IUPAC Name:
5-hydroxy-3-[(4-nitrophenyl)methyl]imidazole-4-carboxamide
InChI:
InChI=1S/C11H10N4O4/c12-10(16)9-11(17)13-6-14(9)5-7-1-3-8(4-2-7)15(18)19/h1-4,6,17H,5H2,(H2,12,16)
InChI Key:
AKCWLEUBZPTWCV-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)Cn1cnc(c1C(=O)N)O
Properties
Complexity:
351
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.07g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
262.225g/mol
Monoisotopic Mass:
262.07g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
127A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.