4-(5-chloro-2-fluorophenyl)-2-(3-hydroxyphenyl)-1-(2-methylalanyl)-2,5-dihydro-1H-pyrrole

HCID 59656602
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Basic information

Standard SMILES
CC(C)(N)C(=O)N1CC(c2cc(Cl)ccc2F)=CC1c1cccc(O)c1
InChIKey
OFLOYICBNIEQMU-UHFFFAOYSA-N
Molecular formula
C20H20ClFN2O2
Average molar mass
374.8 g/mol
Monoisotopic mass
374.1197337

Names & identifiers

Preferred name
4-(5-chloro-2-fluorophenyl)-2-(3-hydroxyphenyl)-1-(2-methylalanyl)-2,5-dihydro-1H-pyrrole
IUPAC
2-amino-1-[4-(5-chloro-2-fluorophenyl)-2-(3-hydroxyphenyl)-2,5-dihydropyrrol-1-yl]-2-methylpropan-1-one

Names & synonyms

SCHEMBL4064573OFLOYICBNIEQMU-UHFFFAOYSA-N4-(5-chloro-2-fluorophenyl)-2-(3-hydroxyphenyl)-1-(2-methylalanyl)-2,5-dihydro-1H-pyrrole

Database identifiers

PubChem CID
59656602

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
66.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
26

Related reactions

4 records
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Compound notes

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