(3,5-difluorophenyl)-(1,3-thiazol-2-yl)methanol

C10H7F2NOS — CID 19426962

IUPAC(3,5-difluorophenyl)-(1,3-thiazol-2-yl)methanol
SMILESOC(c1cc(F)cc(F)c1)c1nccs1
InChIInChI=1S/C10H7F2NOS/c11-7-3-6(4-8(12)5-7)9(14)10-13-1-2-15-10/h1-5,9,14H
InChIKeyHBWZNKYMAQCJAO-UHFFFAOYSA-N
MW227.24 g/mol
LogP2.50
Rot. Bonds2

About (3,5-difluorophenyl)-(1,3-thiazol-2-yl)methanol

(3,5-difluorophenyl)-(1,3-thiazol-2-yl)methanol (PubChem CID 19426962) has the molecular formula C10H7F2NOS and a molecular weight of 227.24 g/mol. Its IUPAC name is (3,5-difluorophenyl)-(1,3-thiazol-2-yl)methanol.

Molecular Properties

Compound Name(3,5-difluorophenyl)-(1,3-thiazol-2-yl)methanol
PubChem CID19426962
Molecular FormulaC10H7F2NOS
Molecular Weight227.24 g/mol
Exact Mass227.02
IUPAC Name(3,5-difluorophenyl)-(1,3-thiazol-2-yl)methanol
SMILESOC(c1cc(F)cc(F)c1)c1nccs1
InChIInChI=1S/C10H7F2NOS/c11-7-3-6(4-8(12)5-7)9(14)10-13-1-2-15-10/h1-5,9,14H
InChIKeyHBWZNKYMAQCJAO-UHFFFAOYSA-N
XLogP2.50
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.24
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3,5-difluorophenyl)-(1,3-thiazol-2-yl)methanol?
The IUPAC name of (3,5-difluorophenyl)-(1,3-thiazol-2-yl)methanol (CID 19426962) is (3,5-difluorophenyl)-(1,3-thiazol-2-yl)methanol.
What is the SMILES notation for (3,5-difluorophenyl)-(1,3-thiazol-2-yl)methanol?
The canonical SMILES for (3,5-difluorophenyl)-(1,3-thiazol-2-yl)methanol is OC(c1cc(F)cc(F)c1)c1nccs1.
What is the InChIKey of (3,5-difluorophenyl)-(1,3-thiazol-2-yl)methanol?
The InChIKey is HBWZNKYMAQCJAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7F2NOS/c11-7-3-6(4-8(12)5-7)9(14)10-13-1-2-15-10/h1-5,9,14H.
What are the key properties of (3,5-difluorophenyl)-(1,3-thiazol-2-yl)methanol?
(3,5-difluorophenyl)-(1,3-thiazol-2-yl)methanol has a molecular weight of 227.24 g/mol, XLogP of 2.50, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-difluorophenyl)-(1,3-thiazol-2-yl)methanol is sourced from PubChem (CID 19426962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).