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N,4-Dimethyl-N-(4-methylbenzene-1-sulfonyl)benzamide

HCID 2383041
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
748793-14-8
Standard SMILES
Cc1ccc(C(=O)N(C)S(=O)(=O)c2ccc(C)cc2)cc1
InChIKey
NYQGRTLHGXEQKM-UHFFFAOYSA-N
Molecular formula
C16H17NO3S
Average molar mass
303.4 g/mol
Monoisotopic mass
303.09291458

Names & identifiers

Preferred name
N,4-Dimethyl-N-(4-methylbenzene-1-sulfonyl)benzamide
IUPAC
N,4-dimethyl-N-(4-methylphenyl)sulfonylbenzamide

Names & synonyms

748793-14-8Enamine_003734SCHEMBL5880393DTXSID50368344HMS1404J16AKOS008028441IDI1_007377N,4-Dimethyl-N-(4-methylbenzene-1-sulfonyl)benzamideZ56853787T0510-6021

Database identifiers

CAS
748793-14-8
PubChem CID
2383041
DTXSID
DTXSID50368344
Nikkaji
J3.460.083J

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
62.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
21
Formal charge
0
Complexity
452

Related reactions

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Compound notes

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