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88778-24-9 | Benzamide, N,N'-1,3-phenylenebis[3-amino-N-methyl-
CAS No: 88778-24-9 Catalog No: AG004CZG MDL No:
Product Description
Catalog Number:
AG004CZG
Chemical Name:
Benzamide, N,N'-1,3-phenylenebis[3-amino-N-methyl-
CAS Number:
88778-24-9
Molecular Formula:
C22H22N4O2
Molecular Weight:
374.4357
IUPAC Name:
3-amino-N-[3-[(3-aminobenzoyl)-methylamino]phenyl]-N-methylbenzamide
InChI:
InChI=1S/C22H22N4O2/c1-25(21(27)15-6-3-8-17(23)12-15)19-10-5-11-20(14-19)26(2)22(28)16-7-4-9-18(24)13-16/h3-14H,23-24H2,1-2H3
InChI Key:
XEGWNPAMTPMIHT-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1)C(=O)N(c1cccc(c1)N(C(=O)c1cccc(c1)N)C)C
Properties
Complexity:
509
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
374.174g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
374.444g/mol
Monoisotopic Mass:
374.174g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
92.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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