[4-[2-(difluoromethoxy)phenyl]-1,3-thiazol-2-yl]methanol

C11H9F2NO2S — CID 55157591

IUPAC[4-[2-(difluoromethoxy)phenyl]-1,3-thiazol-2-yl]methanol
SMILESOCc1nc(-c2ccccc2OC(F)F)cs1
InChIInChI=1S/C11H9F2NO2S/c12-11(13)16-9-4-2-1-3-7(9)8-6-17-10(5-15)14-8/h1-4,6,11,15H,5H2
InChIKeyPACQMPGMYFPWNS-UHFFFAOYSA-N
MW257.26 g/mol
LogP2.90
Rot. Bonds4

About [4-[2-(difluoromethoxy)phenyl]-1,3-thiazol-2-yl]methanol

[4-[2-(difluoromethoxy)phenyl]-1,3-thiazol-2-yl]methanol (PubChem CID 55157591) has the molecular formula C11H9F2NO2S and a molecular weight of 257.26 g/mol. Its IUPAC name is [4-[2-(difluoromethoxy)phenyl]-1,3-thiazol-2-yl]methanol.

Molecular Properties

Compound Name[4-[2-(difluoromethoxy)phenyl]-1,3-thiazol-2-yl]methanol
PubChem CID55157591
Molecular FormulaC11H9F2NO2S
Molecular Weight257.26 g/mol
Exact Mass257.03
IUPAC Name[4-[2-(difluoromethoxy)phenyl]-1,3-thiazol-2-yl]methanol
SMILESOCc1nc(-c2ccccc2OC(F)F)cs1
InChIInChI=1S/C11H9F2NO2S/c12-11(13)16-9-4-2-1-3-7(9)8-6-17-10(5-15)14-8/h1-4,6,11,15H,5H2
InChIKeyPACQMPGMYFPWNS-UHFFFAOYSA-N
XLogP2.90
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.26
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(hydroxymethyl)-1,3-thiazol-4-yl]phenol
CID 105460333
[4-(2-chlorophenyl)-1,3-thiazol-2-yl]methanol
CID 46785514
[3-[2-(difluoromethoxy)phenyl]-1,2-oxazol-5-yl]methanol
CID 178133095
N-[4-[2-(difluoromethoxy)phenyl]-1,3-thiazol-2-yl]-4-oxo-4-thiophen-2-ylbutanamide
CID 86885324
(3R)-3-benzyl-4-[[4-[2-(difluoromethoxy)phenyl]-1,3-thiazol-2-yl]-methoxyamino]-4-oxobutanoic acid
CID 151752193
2-[2-(difluoromethoxy)phenyl]-4-phenylquinoline
CID 8966170
1-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-N-methylmethanamine
CID 4212091
N-[4-[2-(difluoromethoxy)phenyl]-1,3-thiazol-2-yl]pyrrolidine-2-carboxamide;hydrochloride
CID 119317540
N-[4-[2-(difluoromethoxy)phenyl]-1,3-thiazol-2-yl]-2-(2-nitroanilino)acetamide
CID 56573359
5-[2-(difluoromethoxy)phenyl]-2H-tetrazole
CID 7017704
2-[4-[2-(difluoromethoxy)-5-methylphenyl]-1,3-thiazol-2-yl]-N-(4-methylphenyl)acetamide
CID 18287994
[4-(5-bromo-2-methoxyphenyl)-1,3-thiazol-2-yl]methanol
CID 82124686

Frequently Asked Questions

What is the IUPAC name of [4-[2-(difluoromethoxy)phenyl]-1,3-thiazol-2-yl]methanol?
The IUPAC name of [4-[2-(difluoromethoxy)phenyl]-1,3-thiazol-2-yl]methanol (CID 55157591) is [4-[2-(difluoromethoxy)phenyl]-1,3-thiazol-2-yl]methanol.
What is the SMILES notation for [4-[2-(difluoromethoxy)phenyl]-1,3-thiazol-2-yl]methanol?
The canonical SMILES for [4-[2-(difluoromethoxy)phenyl]-1,3-thiazol-2-yl]methanol is OCc1nc(-c2ccccc2OC(F)F)cs1.
What is the InChIKey of [4-[2-(difluoromethoxy)phenyl]-1,3-thiazol-2-yl]methanol?
The InChIKey is PACQMPGMYFPWNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9F2NO2S/c12-11(13)16-9-4-2-1-3-7(9)8-6-17-10(5-15)14-8/h1-4,6,11,15H,5H2.
What are the key properties of [4-[2-(difluoromethoxy)phenyl]-1,3-thiazol-2-yl]methanol?
[4-[2-(difluoromethoxy)phenyl]-1,3-thiazol-2-yl]methanol has a molecular weight of 257.26 g/mol, XLogP of 2.90, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[2-(difluoromethoxy)phenyl]-1,3-thiazol-2-yl]methanol is sourced from PubChem (CID 55157591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).