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

HCID 22244530
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Basic information

Standard SMILES
Cc1nn(-c2ccc(CCNC(=O)NS(=O)(=O)c3ccc(S(C)(=O)=O)cc3)cc2)c(C)c1-c1ccccc1
InChIKey
RAGQFSXFSCCKFJ-UHFFFAOYSA-N
Molecular formula
C27H28N4O5S2
Average molar mass
552.7 g/mol

Names & identifiers

Preferred name
N-[({2-[4-(3,5-dimethyl-4-phenyl-1H-pyrazol-1-yl)phenyl]ethyl}amino) carbonyl]-4-(methylsulfonyl)benzenesulfonamide
IUPAC
1-[2-[4-(3,5-dimethyl-4-phenylpyrazol-1-yl)phenyl]ethyl]-3-(4-methylsulfonylphenyl)sulfonylurea

Names & synonyms

SCHEMBL6097878RAGQFSXFSCCKFJ-UHFFFAOYSA-NN-[({2-[4-(3,5-dimethyl-4-phenyl-1H-pyrazol-1-yl)phenyl]ethyl}amino) carbonyl]-4-(methylsulfonyl)benzenesulfonamide

Database identifiers

PubChem CID
22244530

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
144 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
8
Heavy atoms
38

Related reactions

2 records
New reaction record

Compound notes

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