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88011-75-0 | Benzamide, N-[[[4-(1,1-dimethylethyl)phenyl]amino]carbonyl]-2-methyl-
CAS No: 88011-75-0 Catalog No: AG004KHB MDL No:
Product Description
Catalog Number:
AG004KHB
Chemical Name:
Benzamide, N-[[[4-(1,1-dimethylethyl)phenyl]amino]carbonyl]-2-methyl-
CAS Number:
88011-75-0
Molecular Formula:
C19H22N2O2
Molecular Weight:
310.3902
IUPAC Name:
N-[(4-tert-butylphenyl)carbamoyl]-2-methylbenzamide
InChI:
InChI=1S/C19H22N2O2/c1-13-7-5-6-8-16(13)17(22)21-18(23)20-15-11-9-14(10-12-15)19(2,3)4/h5-12H,1-4H3,(H2,20,21,22,23)
InChI Key:
CSNLACYAAWWUGU-UHFFFAOYSA-N
SMILES:
O=C(NC(=O)c1ccccc1C)Nc1ccc(cc1)C(C)(C)C
Properties
Complexity:
420
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.168g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
310.397g/mol
Monoisotopic Mass:
310.168g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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