2,4-dichloro-6-methyl-7-[(4-methylphenyl)sulfonyl]-7H-pyrrolo[2,3-d]pyrimidine

HCID 58398917
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Basic information

Standard SMILES
Cc1ccc(S(=O)(=O)n2c(C)cc3c(Cl)nc(Cl)nc32)cc1
InChIKey
YYDUNBNZAAOUJY-UHFFFAOYSA-N
Molecular formula
C14H11Cl2N3O2S
Average molar mass
356.2 g/mol

Names & identifiers

Preferred name
2,4-dichloro-6-methyl-7-[(4-methylphenyl)sulfonyl]-7H-pyrrolo[2,3-d]pyrimidine
IUPAC
2,4-dichloro-6-methyl-7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidine

Names & synonyms

SCHEMBL2203328YYDUNBNZAAOUJY-UHFFFAOYSA-N2,4-dichloro-6-methyl-7-[(4-methylphenyl)sulfonyl]-7H-pyrrolo[2,3-d]pyrimidine

Database identifiers

PubChem CID
58398917

Properties

Computed structural properties

XLogP
4.5
Topological polar surface area
73.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
22

Related reactions

4 records
New reaction record

Compound notes

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