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1373243-63-0 | 3-Benzofurancarboxamide, N-(2-bromophenyl)-2-methyl-
CAS No: 1373243-63-0 Catalog No: AG001357 MDL No:
Product Description
Catalog Number:
AG001357
Chemical Name:
3-Benzofurancarboxamide, N-(2-bromophenyl)-2-methyl-
CAS Number:
1373243-63-0
Molecular Formula:
C16H12BrNO2
Molecular Weight:
330.1760
IUPAC Name:
N-(2-bromophenyl)-2-methyl-1-benzofuran-3-carboxamide
InChI:
InChI=1S/C16H12BrNO2/c1-10-15(11-6-2-5-9-14(11)20-10)16(19)18-13-8-4-3-7-12(13)17/h2-9H,1H3,(H,18,19)
InChI Key:
FGYOVCUDLVKTTQ-UHFFFAOYSA-N
SMILES:
Brc1ccccc1NC(=O)c1c(C)oc2c1cccc2
Properties
Complexity:
362
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.005g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
330.181g/mol
Monoisotopic Mass:
329.005g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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