3-(3-[(2-Chloro-4-cyclopentyloxybenzoyl)amino]methyl-4-methoxyphenyl)-2-isopropoxypropanoic acid

HCID 22493944
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Basic information

Standard SMILES
COc1ccc(CC(OC(C)C)C(=O)O)cc1CNC(=O)c1ccc(OC2CCCC2)cc1Cl
InChIKey
QQYRWHULVLSCCV-UHFFFAOYSA-N
Molecular formula
C26H32ClNO6
Average molar mass
490 g/mol

Names & identifiers

Preferred name
3-(3-[(2-Chloro-4-cyclopentyloxybenzoyl)amino]methyl-4-methoxyphenyl)-2-isopropoxypropanoic acid
IUPAC
3-[3-[[(2-chloro-4-cyclopentyloxybenzoyl)amino]methyl]-4-methoxyphenyl]-2-propan-2-yloxypropanoic acid

Names & synonyms

SCHEMBL6506584QQYRWHULVLSCCV-UHFFFAOYSA-N3-(3-[(2-chloro-4-cyclopentyloxybenzoyl)amino]methyl-4-methoxyphenyl)-2-isopropoxypropanoic acid

Database identifiers

PubChem CID
22493944

Properties

Computed structural properties

XLogP
5.1
Topological polar surface area
94.1 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
11
Heavy atoms
34

Related reactions

2 records
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Compound notes

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