4-methoxy-2-(5-methyl-1-tosyl-1H-indazol-4-yl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine

HCID 71240657
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Basic information

Standard SMILES
COc1nc(-c2c(C)ccc3c2cnn3S(=O)(=O)c2ccc(C)cc2)nc2c1CNCC2
InChIKey
MLZSKQRHCNJCQJ-UHFFFAOYSA-N
Molecular formula
C23H23N5O3S
Average molar mass
449.5 g/mol

Names & identifiers

Preferred name
4-methoxy-2-(5-methyl-1-tosyl-1H-indazol-4-yl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine
IUPAC
4-methoxy-2-[5-methyl-1-(4-methylphenyl)sulfonylindazol-4-yl]-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine

Names & synonyms

SCHEMBL14663120MLZSKQRHCNJCQJ-UHFFFAOYSA-N4-methoxy-2-(5-methyl-1-tosyl-1H-indazol-4-yl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine

Database identifiers

PubChem CID
71240657

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
107 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
4
Heavy atoms
32

Related reactions

2 records
New reaction record

Compound notes

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