[5-(3-chloro-4-hydroxyphenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone

C18H11ClFNO3 — CID 56969904

IUPAC[5-(3-chloro-4-hydroxyphenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone
SMILESO=C(c1ccc(F)c(O)c1)c1ccc(-c2ccc(O)c(Cl)c2)cn1
InChIInChI=1S/C18H11ClFNO3/c19-13-7-10(3-6-16(13)22)12-2-5-15(21-9-12)18(24)11-1-4-14(20)17(23)8-11/h1-9,22-23H
InChIKeyLTYHEYYAHVTUTG-UHFFFAOYSA-N
MW343.74 g/mol
LogP4.18
Rot. Bonds3

About [5-(3-chloro-4-hydroxyphenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone

[5-(3-chloro-4-hydroxyphenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone (PubChem CID 56969904) has the molecular formula C18H11ClFNO3 and a molecular weight of 343.74 g/mol. Its IUPAC name is [5-(3-chloro-4-hydroxyphenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone.

Molecular Properties

Compound Name[5-(3-chloro-4-hydroxyphenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone
PubChem CID56969904
Molecular FormulaC18H11ClFNO3
Molecular Weight343.74 g/mol
Exact Mass343.04
IUPAC Name[5-(3-chloro-4-hydroxyphenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone
SMILESO=C(c1ccc(F)c(O)c1)c1ccc(-c2ccc(O)c(Cl)c2)cn1
InChIInChI=1S/C18H11ClFNO3/c19-13-7-10(3-6-16(13)22)12-2-5-15(21-9-12)18(24)11-1-4-14(20)17(23)8-11/h1-9,22-23H
InChIKeyLTYHEYYAHVTUTG-UHFFFAOYSA-N
XLogP4.18
TPSA70.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.74
LogP ≤ 54.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[5-(4-Hydroxy-3-methylphenyl)-2-pyridinyl]-(3-hydroxyphenyl)methanone
CID 56969902
(4-Fluoro-3-hydroxyphenyl)-[5-(4-hydroxy-3-methylphenyl)-2-pyridinyl]methanone
CID 56969903
(4-Fluoro-3-hydroxyphenyl)-[5-(3-fluoro-4-hydroxyphenyl)-2-pyridinyl]methanone
CID 134132086
[6-(3-Chloro-4-fluorophenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone
CID 134147999
(4-Fluoro-3-hydroxyphenyl)-(6-phenyl-2-pyridinyl)methanone
CID 134154234
[6-(3-Chloro-4-hydroxyphenyl)-2-pyridinyl]-(3-hydroxyphenyl)methanone
CID 136042246
[6-(3-Fluoro-4-hydroxyphenyl)-2-pyridinyl]-(3-hydroxyphenyl)methanone
CID 136068369
(4-Fluoro-3-hydroxyphenyl)-[6-(3-fluoro-4-hydroxyphenyl)-2-pyridinyl]methanone
CID 137283363
2-(4-Fluoro-3-hydroxybenzoyl)pyridine
CID 118814313
(E)-3-(3-chloro-5-fluoro-4-hydroxyphenyl)-1-pyridin-4-ylprop-2-en-1-one
CID 127048965
[6-(2-Fluoro-4-hydroxyphenyl)-2-pyridinyl]-(3-hydroxyphenyl)methanone
CID 136068368
(2-Chlorophenyl)-[1-[(4-hydroxyphenyl)methyl]pyrrol-2-yl]methanone
CID 177375492

Frequently Asked Questions

What is the IUPAC name of [5-(3-chloro-4-hydroxyphenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone?
The IUPAC name of [5-(3-chloro-4-hydroxyphenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone (CID 56969904) is [5-(3-chloro-4-hydroxyphenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone.
What is the SMILES notation for [5-(3-chloro-4-hydroxyphenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone?
The canonical SMILES for [5-(3-chloro-4-hydroxyphenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone is O=C(c1ccc(F)c(O)c1)c1ccc(-c2ccc(O)c(Cl)c2)cn1.
What is the InChIKey of [5-(3-chloro-4-hydroxyphenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone?
The InChIKey is LTYHEYYAHVTUTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H11ClFNO3/c19-13-7-10(3-6-16(13)22)12-2-5-15(21-9-12)18(24)11-1-4-14(20)17(23)8-11/h1-9,22-23H.
What are the key properties of [5-(3-chloro-4-hydroxyphenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone?
[5-(3-chloro-4-hydroxyphenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone has a molecular weight of 343.74 g/mol, XLogP of 4.18, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(3-chloro-4-hydroxyphenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone is sourced from PubChem (CID 56969904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).