2-Isopropoxy-3-[4-methoxy-3-({[2-methoxy-4-(trifluoromethyl)benzoyl]amino}methyl)phenyl]propanoic acid

HCID 22493953
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Basic information

Standard SMILES
COc1ccc(CC(OC(C)C)C(=O)O)cc1CNC(=O)c1ccc(C(F)(F)F)cc1OC
InChIKey
UAYPXPBXHMVXGF-UHFFFAOYSA-N
Molecular formula
C23H26F3NO6
Average molar mass
469.4 g/mol

Names & identifiers

Preferred name
2-Isopropoxy-3-[4-methoxy-3-({[2-methoxy-4-(trifluoromethyl)benzoyl]amino}methyl)phenyl]propanoic acid
IUPAC
3-[4-methoxy-3-[[[2-methoxy-4-(trifluoromethyl)benzoyl]amino]methyl]phenyl]-2-propan-2-yloxypropanoic acid

Names & synonyms

2-isopropoxy-3-[4-methoxy-3-({[2-methoxy-4-(trifluoromethyl)benzoyl]amino}methyl)phenyl]propanoic acidSCHEMBL6494551

Database identifiers

PubChem CID
22493953

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
94.1 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
9
Rotatable bonds
10
Heavy atoms
33

Related reactions

1 records
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Compound notes

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