7-(4-((2,3-dihydro-1H-inden-2-yl)carbamoyl) phenoxy)-6-cyano-3,4-dihydro-2H-chromene-4-carboxylic acid

HCID 44599103

Basic information

Standard SMILES
N#Cc1cc2c(cc1Oc1ccc(C(=O)NC3Cc4ccccc4C3)cc1)OCCC2C(=O)O
InChIKey
IQMMKHWRYBHBSV-UHFFFAOYSA-N
Molecular formula
C27H22N2O5
Average molar mass
454.5 g/mol

Names & identifiers

Preferred name
7-(4-((2,3-dihydro-1H-inden-2-yl)carbamoyl) phenoxy)-6-cyano-3,4-dihydro-2H-chromene-4-carboxylic acid
IUPAC
6-cyano-7-[4-(2,3-dihydro-1H-inden-2-ylcarbamoyl)phenoxy]-3,4-dihydro-2H-chromene-4-carboxylic acid

Names & synonyms

SCHEMBL1571213CHEMBL5838067IQMMKHWRYBHBSV-UHFFFAOYSA-NBDBM230038US9556139, 66-Cyano-7-(4-(2,3-dihydro-1H-inden-2-ylcarbamoyl)phenoxy)chroman-4-carboxylic acid7-(4-((2,3-dihydro-1H-inden-2-yl)carbamoyl) phenoxy)-6-cyano-3,4-dihydro-2H-chromene-4-carboxylic acid7-(4-((2,3-dihydro-1H-inden-2-yl)carbamoyl)phenoxy)-6-cyano-3,4-dihydro-2H-chromene-4-carboxylic acid

Database identifiers

PubChem CID
44599103
ChEMBL
CHEMBL5838067

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
109 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
34

Related reactions

4 records

Compound notes

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