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2-(propan-2-ylamino)-N-[4-[4-[[2-(propan-2-ylamino)acetyl]amino]phenyl]sulfonylphenyl]acetamide

HCID 259983
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
32794-94-8
Standard SMILES
CC(C)NCC(=O)Nc1ccc(S(=O)(=O)c2ccc(NC(=O)CNC(C)C)cc2)cc1
InChIKey
GSFHVBVBBLUMGE-UHFFFAOYSA-N
Molecular formula
C22H30N4O4S
Average molar mass
446.6 g/mol
Monoisotopic mass
446.19877662

Names & identifiers

Preferred name
2-(propan-2-ylamino)-N-[4-[4-[[2-(propan-2-ylamino)acetyl]amino]phenyl]sulfonylphenyl]acetamide
IUPAC
2-(propan-2-ylamino)-N-[4-[4-[[2-(propan-2-ylamino)acetyl]amino]phenyl]sulfonylphenyl]acetamide

Names & synonyms

NSC90767NSC-9076732794-94-8

Database identifiers

CAS
32794-94-8
PubChem CID
259983

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
125 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
6
Rotatable bonds
10
Heavy atoms
31
Formal charge
0
Complexity
622

Related reactions

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Compound notes

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