4-chloro-N-(2-oxo-azepan-3-yl)-N-(4-pyrazol-1-yl-benzyl)-benzenesulfonamide

HCID 69489249
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Basic information

Standard SMILES
O=C1NCCCCC1N(Cc1ccc(-n2cccn2)cc1)S(=O)(=O)c1ccc(Cl)cc1
InChIKey
SNZNEDLYDZAZDP-UHFFFAOYSA-N
Molecular formula
C22H23ClN4O3S
Average molar mass
459 g/mol

Names & identifiers

Preferred name
4-chloro-N-(2-oxo-azepan-3-yl)-N-(4-pyrazol-1-yl-benzyl)-benzenesulfonamide
IUPAC
4-chloro-N-(2-oxoazepan-3-yl)-N-[(4-pyrazol-1-ylphenyl)methyl]benzenesulfonamide

Names & synonyms

SCHEMBL5562401SNZNEDLYDZAZDP-UHFFFAOYSA-N4-chloro-N-(2-oxo-azepan-3-yl)-N-(4-pyrazol-1-yl-benzyl)-benzenesulfonamide

Database identifiers

PubChem CID
69489249

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
92.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
31

Related reactions

2 records
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Compound notes

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