[3-fluoro-5-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]phenyl]methanol

C11H10FNOS2 — CID 106533853

IUPAC[3-fluoro-5-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]phenyl]methanol
SMILESCc1csc(Sc2cc(F)cc(CO)c2)n1
InChIInChI=1S/C11H10FNOS2/c1-7-6-15-11(13-7)16-10-3-8(5-14)2-9(12)4-10/h2-4,6,14H,5H2,1H3
InChIKeyNETQWTXDNABUEE-UHFFFAOYSA-N
MW255.34 g/mol
LogP3.23
Rot. Bonds3

About [3-fluoro-5-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]phenyl]methanol

[3-fluoro-5-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]phenyl]methanol (PubChem CID 106533853) has the molecular formula C11H10FNOS2 and a molecular weight of 255.34 g/mol. Its IUPAC name is [3-fluoro-5-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]phenyl]methanol.

Molecular Properties

Compound Name[3-fluoro-5-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]phenyl]methanol
PubChem CID106533853
Molecular FormulaC11H10FNOS2
Molecular Weight255.34 g/mol
Exact Mass255.02
IUPAC Name[3-fluoro-5-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]phenyl]methanol
SMILESCc1csc(Sc2cc(F)cc(CO)c2)n1
InChIInChI=1S/C11H10FNOS2/c1-7-6-15-11(13-7)16-10-3-8(5-14)2-9(12)4-10/h2-4,6,14H,5H2,1H3
InChIKeyNETQWTXDNABUEE-UHFFFAOYSA-N
XLogP3.23
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.34
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [3-fluoro-5-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]phenyl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[3-fluoro-5-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]phenyl]methanamine
CID 102818678
ethane;(3-fluoro-5-methylsulfanylphenyl)methanol
CID 176708599
[5-methyl-6-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-pyridinyl]methanol
CID 80651358
[6-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-pyridinyl]methanol
CID 80651278
3-[3-fluoro-5-(hydroxymethyl)phenyl]sulfanyl-2-methyl-1H-1,2,4-triazine-5,6-dione
CID 107783563
[3-fluoro-5-[(3-methyl-1,2,4-thiadiazol-5-yl)sulfanyl]phenyl]methanamine
CID 102818800
4-methyl-2-(4-methylphenyl)sulfanyl-1,3-thiazole
CID 25496142
2-(2,6-difluoropyrimidin-4-yl)sulfanyl-4-methyl-1,3-thiazole
CID 164647838
methyl 2-[3-fluoro-5-(hydroxymethyl)phenyl]sulfanylacetate
CID 106533869
5-fluoro-2-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzoic acid
CID 63293267
1-(3-fluorophenyl)-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]ethanone
CID 43226524
[5-fluoro-2-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]phenyl]methanamine
CID 63289440

Frequently Asked Questions

What is the IUPAC name of [3-fluoro-5-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]phenyl]methanol?
The IUPAC name of [3-fluoro-5-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]phenyl]methanol (CID 106533853) is [3-fluoro-5-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]phenyl]methanol.
What is the SMILES notation for [3-fluoro-5-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]phenyl]methanol?
The canonical SMILES for [3-fluoro-5-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]phenyl]methanol is Cc1csc(Sc2cc(F)cc(CO)c2)n1.
What is the InChIKey of [3-fluoro-5-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]phenyl]methanol?
The InChIKey is NETQWTXDNABUEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FNOS2/c1-7-6-15-11(13-7)16-10-3-8(5-14)2-9(12)4-10/h2-4,6,14H,5H2,1H3.
What are the key properties of [3-fluoro-5-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]phenyl]methanol?
[3-fluoro-5-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]phenyl]methanol has a molecular weight of 255.34 g/mol, XLogP of 3.23, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-fluoro-5-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]phenyl]methanol is sourced from PubChem (CID 106533853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).