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N-[[4-[(5-chlorothiophen-2-yl)methyl]morpholin-2-yl]methyl]-2-[3-(methanesulfonamido)phenyl]acetamide

HCID 21962817
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CS(=O)(=O)Nc1cccc(CC(=O)NCC2CN(Cc3ccc(Cl)s3)CCO2)c1
InChIKey
VOSAXWZFOHNAKO-UHFFFAOYSA-N
Molecular formula
C19H24ClN3O4S2
Average molar mass
458 g/mol
Monoisotopic mass
457.0896763

Names & identifiers

Preferred name
N-[[4-[(5-chlorothiophen-2-yl)methyl]morpholin-2-yl]methyl]-2-[3-(methanesulfonamido)phenyl]acetamide
IUPAC
N-[[4-[(5-chlorothiophen-2-yl)methyl]morpholin-2-yl]methyl]-2-[3-(methanesulfonamido)phenyl]acetamide

Names & synonyms

SCHEMBL4021455

Database identifiers

PubChem CID
21962817

Properties

Computed structural properties

XLogP
2
Topological polar surface area
124 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
8
Heavy atoms
29
Formal charge
0
Complexity
646

Related reactions

1 records
New reaction record
HRID 953363 reaction equation
HRID 953363As productValidation data from https://doi.org/10.1039/C8SC04228D

Compound notes

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