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89722-56-5 | Propanamide, 3-chloro-N-(5,6-dimethoxy-1H-benzimidazol-2-yl)-
CAS No: 89722-56-5 Catalog No: AG0042FY MDL No:
Product Description
Catalog Number:
AG0042FY
Chemical Name:
Propanamide, 3-chloro-N-(5,6-dimethoxy-1H-benzimidazol-2-yl)-
CAS Number:
89722-56-5
Molecular Formula:
C12H14ClN3O3
Molecular Weight:
283.7109
IUPAC Name:
3-chloro-N-(5,6-dimethoxy-1H-benzimidazol-2-yl)propanamide
InChI:
InChI=1S/C12H14ClN3O3/c1-18-9-5-7-8(6-10(9)19-2)15-12(14-7)16-11(17)3-4-13/h5-6H,3-4H2,1-2H3,(H2,14,15,16,17)
InChI Key:
URTDANMVTMQUFT-UHFFFAOYSA-N
SMILES:
ClCCC(=O)Nc1nc2c([nH]1)cc(c(c2)OC)OC
Properties
Complexity:
319
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.072g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
283.712g/mol
Monoisotopic Mass:
283.072g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
76.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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