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85873-15-0 | 1H-Imidazole-1-carboxamide, N-(3,4-dichlorophenyl)-2-ethyl-4-methyl-
CAS No: 85873-15-0 Catalog No: AG004WVT MDL No:
Product Description
Catalog Number:
AG004WVT
Chemical Name:
1H-Imidazole-1-carboxamide, N-(3,4-dichlorophenyl)-2-ethyl-4-methyl-
CAS Number:
85873-15-0
Molecular Formula:
C13H13Cl2N3O
Molecular Weight:
298.1678
IUPAC Name:
N-(3,4-dichlorophenyl)-2-ethyl-4-methylimidazole-1-carboxamide
InChI:
InChI=1S/C13H13Cl2N3O/c1-3-12-16-8(2)7-18(12)13(19)17-9-4-5-10(14)11(15)6-9/h4-7H,3H2,1-2H3,(H,17,19)
InChI Key:
HGFPAHJQOPSAFN-UHFFFAOYSA-N
SMILES:
CCc1nc(cn1C(=O)Nc1ccc(c(c1)Cl)Cl)C
Properties
Complexity:
329
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.044g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
298.167g/mol
Monoisotopic Mass:
297.044g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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