4-fluoro-2-(1-phenylbenzimidazol-2-yl)phenol

C19H13FN2O — CID 141447874

IUPAC4-fluoro-2-(1-phenylbenzimidazol-2-yl)phenol
SMILESOc1ccc(F)cc1-c1nc2ccccc2n1-c1ccccc1
InChIInChI=1S/C19H13FN2O/c20-13-10-11-18(23)15(12-13)19-21-16-8-4-5-9-17(16)22(19)14-6-2-1-3-7-14/h1-12,23H
InChIKeyGKYSMONZLASNPJ-UHFFFAOYSA-N
MW304.32 g/mol
LogP4.54
Rot. Bonds2

About 4-fluoro-2-(1-phenylbenzimidazol-2-yl)phenol

4-fluoro-2-(1-phenylbenzimidazol-2-yl)phenol (PubChem CID 141447874) has the molecular formula C19H13FN2O and a molecular weight of 304.32 g/mol. Its IUPAC name is 4-fluoro-2-(1-phenylbenzimidazol-2-yl)phenol.

Molecular Properties

Compound Name4-fluoro-2-(1-phenylbenzimidazol-2-yl)phenol
PubChem CID141447874
Molecular FormulaC19H13FN2O
Molecular Weight304.32 g/mol
Exact Mass304.10
IUPAC Name4-fluoro-2-(1-phenylbenzimidazol-2-yl)phenol
SMILESOc1ccc(F)cc1-c1nc2ccccc2n1-c1ccccc1
InChIInChI=1S/C19H13FN2O/c20-13-10-11-18(23)15(12-13)19-21-16-8-4-5-9-17(16)22(19)14-6-2-1-3-7-14/h1-12,23H
InChIKeyGKYSMONZLASNPJ-UHFFFAOYSA-N
XLogP4.54
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.32
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-(1-phenylbenzimidazol-2-yl)phenol?
The IUPAC name of 4-fluoro-2-(1-phenylbenzimidazol-2-yl)phenol (CID 141447874) is 4-fluoro-2-(1-phenylbenzimidazol-2-yl)phenol.
What is the SMILES notation for 4-fluoro-2-(1-phenylbenzimidazol-2-yl)phenol?
The canonical SMILES for 4-fluoro-2-(1-phenylbenzimidazol-2-yl)phenol is Oc1ccc(F)cc1-c1nc2ccccc2n1-c1ccccc1.
What is the InChIKey of 4-fluoro-2-(1-phenylbenzimidazol-2-yl)phenol?
The InChIKey is GKYSMONZLASNPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13FN2O/c20-13-10-11-18(23)15(12-13)19-21-16-8-4-5-9-17(16)22(19)14-6-2-1-3-7-14/h1-12,23H.
What are the key properties of 4-fluoro-2-(1-phenylbenzimidazol-2-yl)phenol?
4-fluoro-2-(1-phenylbenzimidazol-2-yl)phenol has a molecular weight of 304.32 g/mol, XLogP of 4.54, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-(1-phenylbenzimidazol-2-yl)phenol is sourced from PubChem (CID 141447874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).