3-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]phenol

C15H10FNOS — CID 28942301

IUPAC3-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]phenol
SMILESOc1cccc(-c2nc(-c3ccccc3F)cs2)c1
InChIInChI=1S/C15H10FNOS/c16-13-7-2-1-6-12(13)14-9-19-15(17-14)10-4-3-5-11(18)8-10/h1-9,18H
InChIKeyDOAFKIGHNMYQOU-UHFFFAOYSA-N
MW271.32 g/mol
LogP4.32
Rot. Bonds2

About 3-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]phenol

3-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]phenol (PubChem CID 28942301) has the molecular formula C15H10FNOS and a molecular weight of 271.32 g/mol. Its IUPAC name is 3-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]phenol.

Molecular Properties

Compound Name3-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]phenol
PubChem CID28942301
Molecular FormulaC15H10FNOS
Molecular Weight271.32 g/mol
Exact Mass271.05
IUPAC Name3-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]phenol
SMILESOc1cccc(-c2nc(-c3ccccc3F)cs2)c1
InChIInChI=1S/C15H10FNOS/c16-13-7-2-1-6-12(13)14-9-19-15(17-14)10-4-3-5-11(18)8-10/h1-9,18H
InChIKeyDOAFKIGHNMYQOU-UHFFFAOYSA-N
XLogP4.32
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]phenol?
The IUPAC name of 3-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]phenol (CID 28942301) is 3-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]phenol.
What is the SMILES notation for 3-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]phenol?
The canonical SMILES for 3-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]phenol is Oc1cccc(-c2nc(-c3ccccc3F)cs2)c1.
What is the InChIKey of 3-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]phenol?
The InChIKey is DOAFKIGHNMYQOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10FNOS/c16-13-7-2-1-6-12(13)14-9-19-15(17-14)10-4-3-5-11(18)8-10/h1-9,18H.
What are the key properties of 3-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]phenol?
3-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]phenol has a molecular weight of 271.32 g/mol, XLogP of 4.32, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]phenol is sourced from PubChem (CID 28942301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).