(2-chlorophenyl)-(4-chlorophenyl)-(2-fluoro-3-methoxyphenyl)methanol

C20H15Cl2FO2 — CID 10523621

IUPAC(2-chlorophenyl)-(4-chlorophenyl)-(2-fluoro-3-methoxyphenyl)methanol
SMILESCOc1cccc(C(O)(c2ccc(Cl)cc2)c2ccccc2Cl)c1F
InChIInChI=1S/C20H15Cl2FO2/c1-25-18-8-4-6-16(19(18)23)20(24,13-9-11-14(21)12-10-13)15-5-2-3-7-17(15)22/h2-12,24H,1H3
InChIKeyOTMPKOFSYBHCJO-UHFFFAOYSA-N
MW377.24 g/mol
LogP5.43
Rot. Bonds4

About (2-chlorophenyl)-(4-chlorophenyl)-(2-fluoro-3-methoxyphenyl)methanol

(2-chlorophenyl)-(4-chlorophenyl)-(2-fluoro-3-methoxyphenyl)methanol (PubChem CID 10523621) has the molecular formula C20H15Cl2FO2 and a molecular weight of 377.24 g/mol. Its IUPAC name is (2-chlorophenyl)-(4-chlorophenyl)-(2-fluoro-3-methoxyphenyl)methanol.

Molecular Properties

Compound Name(2-chlorophenyl)-(4-chlorophenyl)-(2-fluoro-3-methoxyphenyl)methanol
PubChem CID10523621
Molecular FormulaC20H15Cl2FO2
Molecular Weight377.24 g/mol
Exact Mass376.04
IUPAC Name(2-chlorophenyl)-(4-chlorophenyl)-(2-fluoro-3-methoxyphenyl)methanol
SMILESCOc1cccc(C(O)(c2ccc(Cl)cc2)c2ccccc2Cl)c1F
InChIInChI=1S/C20H15Cl2FO2/c1-25-18-8-4-6-16(19(18)23)20(24,13-9-11-14(21)12-10-13)15-5-2-3-7-17(15)22/h2-12,24H,1H3
InChIKeyOTMPKOFSYBHCJO-UHFFFAOYSA-N
XLogP5.43
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500377.24
LogP ≤ 55.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2-chlorophenyl)-(4-chlorophenyl)-(2-fluoro-3-methoxyphenyl)methanol?
The IUPAC name of (2-chlorophenyl)-(4-chlorophenyl)-(2-fluoro-3-methoxyphenyl)methanol (CID 10523621) is (2-chlorophenyl)-(4-chlorophenyl)-(2-fluoro-3-methoxyphenyl)methanol.
What is the SMILES notation for (2-chlorophenyl)-(4-chlorophenyl)-(2-fluoro-3-methoxyphenyl)methanol?
The canonical SMILES for (2-chlorophenyl)-(4-chlorophenyl)-(2-fluoro-3-methoxyphenyl)methanol is COc1cccc(C(O)(c2ccc(Cl)cc2)c2ccccc2Cl)c1F.
What is the InChIKey of (2-chlorophenyl)-(4-chlorophenyl)-(2-fluoro-3-methoxyphenyl)methanol?
The InChIKey is OTMPKOFSYBHCJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15Cl2FO2/c1-25-18-8-4-6-16(19(18)23)20(24,13-9-11-14(21)12-10-13)15-5-2-3-7-17(15)22/h2-12,24H,1H3.
What are the key properties of (2-chlorophenyl)-(4-chlorophenyl)-(2-fluoro-3-methoxyphenyl)methanol?
(2-chlorophenyl)-(4-chlorophenyl)-(2-fluoro-3-methoxyphenyl)methanol has a molecular weight of 377.24 g/mol, XLogP of 5.43, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chlorophenyl)-(4-chlorophenyl)-(2-fluoro-3-methoxyphenyl)methanol is sourced from PubChem (CID 10523621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).