2-(2,3-dihydro-1H-indol-1-yl)-4-[(4-methoxybenzyl)oxy]-5-pyrimidinecarboxylic acid

HCID 21990679
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1ccc(COc2nc(N3CCc4ccccc43)ncc2C(=O)O)cc1
InChIKey
OCDQRJUUECQXDZ-UHFFFAOYSA-N
Molecular formula
C21H19N3O4
Average molar mass
377.4 g/mol

Names & identifiers

Preferred name
2-(2,3-dihydro-1H-indol-1-yl)-4-[(4-methoxybenzyl)oxy]-5-pyrimidinecarboxylic acid
IUPAC
2-(2,3-dihydroindol-1-yl)-4-[(4-methoxyphenyl)methoxy]pyrimidine-5-carboxylic acid

Names & synonyms

SCHEMBL5748841OCDQRJUUECQXDZ-UHFFFAOYSA-N2-(2,3-dihydro-1H-indol-1-yl)-4-[(4-methoxybenzyl)oxy]-5-pyrimidinecarboxylic acid

Database identifiers

PubChem CID
21990679

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
84.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
28

Related reactions

2 records
New reaction record

Linked notes

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