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

C10H7F2NOS — CID 23114721

IUPAC(2,5-difluorophenyl)-(1,3-thiazol-2-yl)methanol
SMILESOC(c1nccs1)c1cc(F)ccc1F
InChIInChI=1S/C10H7F2NOS/c11-6-1-2-8(12)7(5-6)9(14)10-13-3-4-15-10/h1-5,9,14H
InChIKeySYOFYWRVTXOLAC-UHFFFAOYSA-N
MW227.24 g/mol
LogP2.50
Rot. Bonds2

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

(2,5-difluorophenyl)-(1,3-thiazol-2-yl)methanol (PubChem CID 23114721) has the molecular formula C10H7F2NOS and a molecular weight of 227.24 g/mol. Its IUPAC name is (2,5-difluorophenyl)-(1,3-thiazol-2-yl)methanol.

Molecular Properties

Compound Name(2,5-difluorophenyl)-(1,3-thiazol-2-yl)methanol
PubChem CID23114721
Molecular FormulaC10H7F2NOS
Molecular Weight227.24 g/mol
Exact Mass227.02
IUPAC Name(2,5-difluorophenyl)-(1,3-thiazol-2-yl)methanol
SMILESOC(c1nccs1)c1cc(F)ccc1F
InChIInChI=1S/C10H7F2NOS/c11-6-1-2-8(12)7(5-6)9(14)10-13-3-4-15-10/h1-5,9,14H
InChIKeySYOFYWRVTXOLAC-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 (2,5-difluorophenyl)-(1,3-thiazol-2-yl)methanol?
The IUPAC name of (2,5-difluorophenyl)-(1,3-thiazol-2-yl)methanol (CID 23114721) is (2,5-difluorophenyl)-(1,3-thiazol-2-yl)methanol.
What is the SMILES notation for (2,5-difluorophenyl)-(1,3-thiazol-2-yl)methanol?
The canonical SMILES for (2,5-difluorophenyl)-(1,3-thiazol-2-yl)methanol is OC(c1nccs1)c1cc(F)ccc1F.
What is the InChIKey of (2,5-difluorophenyl)-(1,3-thiazol-2-yl)methanol?
The InChIKey is SYOFYWRVTXOLAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7F2NOS/c11-6-1-2-8(12)7(5-6)9(14)10-13-3-4-15-10/h1-5,9,14H.
What are the key properties of (2,5-difluorophenyl)-(1,3-thiazol-2-yl)methanol?
(2,5-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 (2,5-difluorophenyl)-(1,3-thiazol-2-yl)methanol is sourced from PubChem (CID 23114721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).