7-methyl-2-propyl-3-[2'-(N-tert-butylaminosulfonyl)[1,1']-biphenyl-4-yl]methyl-6-[(1-oxobutyl)amino]-3H-imidazo[4,5-b]pyridine

HCID 19939760
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Basic information

Standard SMILES
CCCC(=O)Nc1cnc2c(nc(CCC)n2Cc2ccc(-c3ccccc3S(=O)(=O)NC(C)(C)C)cc2)c1C
InChIKey
AAOVNWVMGLFZFE-UHFFFAOYSA-N
Molecular formula
C31H39N5O3S
Average molar mass
561.7 g/mol
Monoisotopic mass
561.2773613

Names & identifiers

Preferred name
7-methyl-2-propyl-3-[2'-(N-tert-butylaminosulfonyl)[1,1']-biphenyl-4-yl]methyl-6-[(1-oxobutyl)amino]-3H-imidazo[4,5-b]pyridine
IUPAC
N-[3-[[4-[2-(tert-butylsulfamoyl)phenyl]phenyl]methyl]-7-methyl-2-propylimidazo[4,5-b]pyridin-6-yl]butanamide

Names & synonyms

SCHEMBL9130208AAOVNWVMGLFZFE-UHFFFAOYSA-N7-methyl-2-propyl-3-[2'-(N-tert-butylaminosulfonyl)[1,1']-biphenyl-4-yl]methyl-6-[(1-oxobutyl)amino]-3H-imidazo[4,5-b]pyridine

Database identifiers

PubChem CID
19939760

Properties

Computed structural properties

XLogP
5.4
Topological polar surface area
114 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
11
Heavy atoms
40

Related reactions

1 records
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Compound notes

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