5,5-Dimethyl-10-hydroxy-8-(3-methyl-2-octyl)-5H-[1]benzopyrano[3,4-d]pyridine

HCID 19781402

Basic information

Standard SMILES
CCCCCC(C)C(C)c1cc(O)c2c(c1)OC(C)(C)c1ccncc1-2
InChIKey
WISKNMYMNRQYOL-UHFFFAOYSA-N
Molecular formula
C23H31NO2
Average molar mass
353.5 g/mol
Monoisotopic mass
353.23547923

Names & identifiers

Preferred name
5,5-Dimethyl-10-hydroxy-8-(3-methyl-2-octyl)-5H-[1]benzopyrano[3,4-d]pyridine
IUPAC
5,5-dimethyl-8-(3-methyloctan-2-yl)chromeno[4,3-c]pyridin-10-ol

Names & synonyms

SCHEMBL9285694CHEMBL3273444WISKNMYMNRQYOL-UHFFFAOYSA-N10-hydroxy-5,5-dimethyl-8-(1,2-dimethylheptyl)-5H-[1]benzopyrano[4,3-c]-pyridine5,5-dimethyl-10-hydroxy-8-(3-methyl-2-octyl)-5H-[1]benzopyrano [3,4-d]pyridine5,5-Dimethyl-10-hydroxy-8-(3-methyl-2-octyl)-5H-[1]benzopyrano[3,4-d]pyridine

Database identifiers

PubChem CID
19781402
ChEMBL
CHEMBL3273444

Properties

Computed structural properties

XLogP
6.3
Topological polar surface area
42.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
26

Related reactions

17 records

Compound notes

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