200,000+ products from a single source!
sales@angenechem.com
Home > Imidazoles > 67218-91-1
67218-91-1 | 1H-Imidazole-4-carboxamide, 5-hydroxy-N-(phenylmethyl)-
CAS No: 67218-91-1 Catalog No: AG006JQR MDL No:
Product Description
Catalog Number:
AG006JQR
Chemical Name:
1H-Imidazole-4-carboxamide, 5-hydroxy-N-(phenylmethyl)-
CAS Number:
67218-91-1
Molecular Formula:
C11H11N3O2
Molecular Weight:
217.2239
IUPAC Name:
N-benzyl-4-hydroxy-1H-imidazole-5-carboxamide
InChI:
InChI=1S/C11H11N3O2/c15-10(9-11(16)14-7-13-9)12-6-8-4-2-1-3-5-8/h1-5,7,16H,6H2,(H,12,15)(H,13,14)
InChI Key:
SHHOFCOWYPQFIV-UHFFFAOYSA-N
SMILES:
O=C(c1nc[nH]c1O)NCc1ccccc1
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.085g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
217.228g/mol
Monoisotopic Mass:
217.085g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
78A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.