N-[({2-[4-(3,5-Dimethyl-4-phenyl-1H-pyrazol-1-yl)phenyl]ethyl}amino)carbonyl]-4-chlorobenzenesulfonamide

HCID 10239271
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Basic information

Standard SMILES
Cc1nn(-c2ccc(CCNC(=O)NS(=O)(=O)c3ccc(Cl)cc3)cc2)c(C)c1-c1ccccc1
InChIKey
GJIIXECRURLNRE-UHFFFAOYSA-N
Molecular formula
C26H25ClN4O3S
Average molar mass
509 g/mol

Names & identifiers

Preferred name
N-[({2-[4-(3,5-Dimethyl-4-phenyl-1H-pyrazol-1-yl)phenyl]ethyl}amino)carbonyl]-4-chlorobenzenesulfonamide
IUPAC
1-(4-chlorophenyl)sulfonyl-3-[2-[4-(3,5-dimethyl-4-phenylpyrazol-1-yl)phenyl]ethyl]urea

Names & synonyms

SCHEMBL6097978GJIIXECRURLNRE-UHFFFAOYSA-NN-[({2-[4-(3,5-Dimethyl-4-phenyl-1H-pyrazol-1-yl)phenyl]ethyl}amino)carbonyl]-4-chlorobenzenesulfonamide

Database identifiers

PubChem CID
10239271

Properties

Computed structural properties

XLogP
5.5
Topological polar surface area
101 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
7
Heavy atoms
35

Related reactions

2 records
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Compound notes

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