4-(3-(3-((4-butylpiperazin-1-yl)(imino)methyl)phenyl)ureido)-N-methylbenzene sulfonamide

HCID 46851984
Substructure searchFind similar structures

Basic information

Standard SMILES
CCCCN1CCN(C(=N)c2cccc(NC(=O)Nc3ccc(S(=O)(=O)NC)cc3)c2)CC1
InChIKey
ASUYGKGBWUKVQE-UHFFFAOYSA-N
Molecular formula
C23H32N6O3S
Average molar mass
472.6 g/mol

Names & identifiers

Preferred name
4-(3-(3-((4-butylpiperazin-1-yl)(imino)methyl)phenyl)ureido)-N-methylbenzene sulfonamide
IUPAC
1-[3-(4-butylpiperazine-1-carboximidoyl)phenyl]-3-[4-(methylsulfamoyl)phenyl]urea

Names & synonyms

SCHEMBL2761989ASUYGKGBWUKVQE-UHFFFAOYSA-N4-(3-(3-((4-butylpiperazin-1-yl)(imino)methyl)phenyl)ureido)-N-methylbenzene sulfonamide

Database identifiers

PubChem CID
46851984

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
126 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
6
Rotatable bonds
9
Heavy atoms
33

Related reactions

2 records
New reaction record

Linked notes

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