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139602-64-5 | Benzamide, 2-[[(2,4-dimethoxyphenyl)methyl]amino]-N-phenyl-
CAS No: 139602-64-5 Catalog No: AG001BCR MDL No:
Product Description
Catalog Number:
AG001BCR
Chemical Name:
Benzamide, 2-[[(2,4-dimethoxyphenyl)methyl]amino]-N-phenyl-
CAS Number:
139602-64-5
Molecular Formula:
C22H22N2O3
Molecular Weight:
362.4217
IUPAC Name:
2-[(2,4-dimethoxyphenyl)methylamino]-N-phenylbenzamide
InChI:
InChI=1S/C22H22N2O3/c1-26-18-13-12-16(21(14-18)27-2)15-23-20-11-7-6-10-19(20)22(25)24-17-8-4-3-5-9-17/h3-14,23H,15H2,1-2H3,(H,24,25)
InChI Key:
REUVNGCEASVGML-UHFFFAOYSA-N
SMILES:
COc1cc(OC)ccc1CNc1ccccc1C(=O)Nc1ccccc1
Properties
Complexity:
453
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
362.163g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
362.429g/mol
Monoisotopic Mass:
362.163g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
59.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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