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87837-82-9 | Benzamide, N-[[[4-(dimethylamino)phenyl]amino]carbonyl]-4-methyl-
CAS No: 87837-82-9 Catalog No: AG004H79 MDL No:
Product Description
Catalog Number:
AG004H79
Chemical Name:
Benzamide, N-[[[4-(dimethylamino)phenyl]amino]carbonyl]-4-methyl-
CAS Number:
87837-82-9
Molecular Formula:
C17H19N3O2
Molecular Weight:
297.3517
IUPAC Name:
N-[[4-(dimethylamino)phenyl]carbamoyl]-4-methylbenzamide
InChI:
InChI=1S/C17H19N3O2/c1-12-4-6-13(7-5-12)16(21)19-17(22)18-14-8-10-15(11-9-14)20(2)3/h4-11H,1-3H3,(H2,18,19,21,22)
InChI Key:
NSEWINHJRUXMBP-UHFFFAOYSA-N
SMILES:
O=C(NC(=O)c1ccc(cc1)C)Nc1ccc(cc1)N(C)C
Properties
Complexity:
381
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.148g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
297.358g/mol
Monoisotopic Mass:
297.148g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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