1h-Pyrrolo[2,3-c]pyridine-5-carboxylic acid,1-[(4-fluorophenyl)methyl]-3-[[(tetrahydro-2h-pyran-4-yl)oxy]methyl]-

HCID 59855851
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Basic information

Standard SMILES
O=C(O)c1cc2c(COC3CCOCC3)cn(Cc3ccc(F)cc3)c2cn1
InChIKey
BOKLAXFYTPVDOA-UHFFFAOYSA-N
Molecular formula
C21H21FN2O4
Average molar mass
384.4 g/mol

Names & identifiers

Preferred name
1h-Pyrrolo[2,3-c]pyridine-5-carboxylic acid,1-[(4-fluorophenyl)methyl]-3-[[(tetrahydro-2h-pyran-4-yl)oxy]methyl]-
IUPAC
1-[(4-fluorophenyl)methyl]-3-(oxan-4-yloxymethyl)pyrrolo[2,3-c]pyridine-5-carboxylic acid

Names & synonyms

1h-pyrrolo[2,3-c]pyridine-5-carboxylic acid,1-[(4-fluorophenyl)methyl]-3-[[(tetrahydro-2h-pyran-4-yl)oxy]methyl]-868551-85-3SCHEMBL4805023BOKLAXFYTPVDOA-UHFFFAOYSA-N1-(4-fluorobenzyl)-3-[(tetrahydro-2H-pyran-4-yloxy)methyl]-1H-pyrrolo[2,3-c]pyridine-5-carboxylic acid

Database identifiers

PubChem CID
59855851

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
73.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
28

Related reactions

2 records
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Linked notes

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