[5-(4-methoxyphenyl)-1,3-thiazol-4-yl]methanol

C11H11NO2S — CID 170459034

IUPAC[5-(4-methoxyphenyl)-1,3-thiazol-4-yl]methanol
SMILESCOc1ccc(-c2scnc2CO)cc1
InChIInChI=1S/C11H11NO2S/c1-14-9-4-2-8(3-5-9)11-10(6-13)12-7-15-11/h2-5,7,13H,6H2,1H3
InChIKeyUKWLXKAFFLSSPU-UHFFFAOYSA-N
MW221.28 g/mol
LogP2.31
Rot. Bonds3

About [5-(4-methoxyphenyl)-1,3-thiazol-4-yl]methanol

[5-(4-methoxyphenyl)-1,3-thiazol-4-yl]methanol (PubChem CID 170459034) has the molecular formula C11H11NO2S and a molecular weight of 221.28 g/mol. Its IUPAC name is [5-(4-methoxyphenyl)-1,3-thiazol-4-yl]methanol.

Molecular Properties

Compound Name[5-(4-methoxyphenyl)-1,3-thiazol-4-yl]methanol
PubChem CID170459034
Molecular FormulaC11H11NO2S
Molecular Weight221.28 g/mol
Exact Mass221.05
IUPAC Name[5-(4-methoxyphenyl)-1,3-thiazol-4-yl]methanol
SMILESCOc1ccc(-c2scnc2CO)cc1
InChIInChI=1S/C11H11NO2S/c1-14-9-4-2-8(3-5-9)11-10(6-13)12-7-15-11/h2-5,7,13H,6H2,1H3
InChIKeyUKWLXKAFFLSSPU-UHFFFAOYSA-N
XLogP2.31
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.28
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[5-(4-chlorophenyl)-1,3-thiazol-4-yl]methanol
CID 170459033
5,6-bis(4-methoxyphenyl)tetrathiine
CID 102027357
[5-[3-(2-propoxyethoxy)phenyl]-1,3-thiazol-4-yl]methanol
CID 136572672
6-(4-methoxyphenyl)-1,3-benzothiazole
CID 91124365
[5-(4-methoxyphenyl)-4-methyl-1,2-oxazol-3-yl]methanol
CID 54846669
[5-[[6-methoxy-2-(4-methoxyphenyl)-1-benzothiophen-3-yl]oxy]-2-pyridinyl]methanol
CID 86730671
(4-methoxyphenyl)methanol
CID 7738
(4-methoxyphenoxy)methanol
CID 20580272
1-(113C)methoxy-4-methylbenzene
CID 166176950
(7-methoxyisoquinolin-3-yl)methanol
CID 133056400
ethane;4-methyl-5-(4-methylphenyl)-1,3-thiazole
CID 156851577
[4-(4-chloro-1,3-thiazol-5-yl)phenyl] acetate
CID 142572982

Frequently Asked Questions

What is the IUPAC name of [5-(4-methoxyphenyl)-1,3-thiazol-4-yl]methanol?
The IUPAC name of [5-(4-methoxyphenyl)-1,3-thiazol-4-yl]methanol (CID 170459034) is [5-(4-methoxyphenyl)-1,3-thiazol-4-yl]methanol.
What is the SMILES notation for [5-(4-methoxyphenyl)-1,3-thiazol-4-yl]methanol?
The canonical SMILES for [5-(4-methoxyphenyl)-1,3-thiazol-4-yl]methanol is COc1ccc(-c2scnc2CO)cc1.
What is the InChIKey of [5-(4-methoxyphenyl)-1,3-thiazol-4-yl]methanol?
The InChIKey is UKWLXKAFFLSSPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO2S/c1-14-9-4-2-8(3-5-9)11-10(6-13)12-7-15-11/h2-5,7,13H,6H2,1H3.
What are the key properties of [5-(4-methoxyphenyl)-1,3-thiazol-4-yl]methanol?
[5-(4-methoxyphenyl)-1,3-thiazol-4-yl]methanol has a molecular weight of 221.28 g/mol, XLogP of 2.31, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(4-methoxyphenyl)-1,3-thiazol-4-yl]methanol is sourced from PubChem (CID 170459034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).