200,000+ products from a single source!
sales@angenechem.com
Home > Imidazoles > 1965304-78-2
1965304-78-2 | 2-(4-Cyanophenyl)-1H-anthra[1,2-d]imidazole-6,11-dione
CAS No: 1965304-78-2 Catalog No: AG01F82U MDL No:
Product Description
Catalog Number:
AG01F82U
Chemical Name:
2-(4-Cyanophenyl)-1H-anthra[1,2-d]imidazole-6,11-dione
CAS Number:
1965304-78-2
Molecular Formula:
C22H13N3O2
Molecular Weight:
351.3575
IUPAC Name:
4-(6,11-dioxo-6a,10a-dihydro-3H-naphtho[2,3-e]benzimidazol-2-yl)benzonitrile
InChI:
InChI=1S/C22H13N3O2/c23-11-12-5-7-13(8-6-12)22-24-17-10-9-16-18(19(17)25-22)21(27)15-4-2-1-3-14(15)20(16)26/h1-10,14-15H,(H,24,25)
InChI Key:
UGFUGVPLBBHUQI-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1)c1nc2c([nH]1)ccc1c2C(=O)C2C=CC=CC2C1=O
Properties
Complexity:
755
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
351.101g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
351.365g/mol
Monoisotopic Mass:
351.101g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
86.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.