Ethanesulfonic acid (6-chloro-5-p-tolyl-pyrimidin-4-yl)-amide

HCID 59645274
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Basic information

Standard SMILES
CCS(=O)(=O)Nc1ncnc(Cl)c1-c1ccc(C)cc1
InChIKey
WLNVWARHPFRSLG-UHFFFAOYSA-N
Molecular formula
C13H14ClN3O2S
Average molar mass
311.79 g/mol

Names & identifiers

Preferred name
Ethanesulfonic acid (6-chloro-5-p-tolyl-pyrimidin-4-yl)-amide
IUPAC
N-[6-chloro-5-(4-methylphenyl)pyrimidin-4-yl]ethanesulfonamide

Names & synonyms

SCHEMBL14289222WLNVWARHPFRSLG-UHFFFAOYSA-Nethanesulfonic acid (6-chloro-5-p-tolyl-pyrimidin-4-yl)-amide

Database identifiers

PubChem CID
59645274

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
80.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
20

Related reactions

4 records
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Linked notes

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