[2-[(4-chlorophenoxy)methyl]-1,3-thiazol-5-yl]methanol

C11H10ClNO2S — CID 82190969

IUPAC[2-[(4-chlorophenoxy)methyl]-1,3-thiazol-5-yl]methanol
SMILESOCc1cnc(COc2ccc(Cl)cc2)s1
InChIInChI=1S/C11H10ClNO2S/c12-8-1-3-9(4-2-8)15-7-11-13-5-10(6-14)16-11/h1-5,14H,6-7H2
InChIKeyNFFFLRGFNQSIAV-UHFFFAOYSA-N
MW255.73 g/mol
LogP2.87
Rot. Bonds4

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

[2-[(4-chlorophenoxy)methyl]-1,3-thiazol-5-yl]methanol (PubChem CID 82190969) has the molecular formula C11H10ClNO2S and a molecular weight of 255.73 g/mol. Its IUPAC name is [2-[(4-chlorophenoxy)methyl]-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name[2-[(4-chlorophenoxy)methyl]-1,3-thiazol-5-yl]methanol
PubChem CID82190969
Molecular FormulaC11H10ClNO2S
Molecular Weight255.73 g/mol
Exact Mass255.01
IUPAC Name[2-[(4-chlorophenoxy)methyl]-1,3-thiazol-5-yl]methanol
SMILESOCc1cnc(COc2ccc(Cl)cc2)s1
InChIInChI=1S/C11H10ClNO2S/c12-8-1-3-9(4-2-8)15-7-11-13-5-10(6-14)16-11/h1-5,14H,6-7H2
InChIKeyNFFFLRGFNQSIAV-UHFFFAOYSA-N
XLogP2.87
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.73
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [2-[(4-chlorophenoxy)methyl]-1,3-thiazol-5-yl]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-[2-[(4-chlorophenoxy)methyl]-1,3-thiazol-5-yl]propanoic acid
CID 82423076
2-[(4-chlorophenoxy)methyl]-1,3-thiazole-5-carbonitrile
CID 82423065
2,5-bis(phenoxymethyl)-1,3-thiazole
CID 90704535
2-[2-[(4-bromophenoxy)methyl]-1,3-thiazol-5-yl]ethanamine
CID 94721333
[2-[(2-methylphenoxy)methyl]-1,3-thiazol-5-yl]methanol
CID 82190879
2-[2-(phenoxymethyl)-1,3-thiazol-5-yl]ethanamine
CID 94686224
N-[[2-[2-(4-chlorophenoxy)ethyl]-1,3-thiazol-5-yl]methyl]ethanamine
CID 82191171
[2-[(2-ethylphenoxy)methyl]-1,3-thiazol-5-yl]methanol
CID 82190907
N-[[2-[(3-chlorophenoxy)methyl]-1,3-thiazol-5-yl]methyl]ethanamine
CID 82190975
3-[2-[(4-fluorophenoxy)methyl]-1,3-thiazol-5-yl]propanoic acid
CID 82423049
2-[2-[(4-bromophenoxy)methyl]-1,3-thiazol-5-yl]acetonitrile
CID 82423092
5-[(4-chlorophenoxy)methyl]thiophene-2-carboxylic acid
CID 19620512

Frequently Asked Questions

What is the IUPAC name of [2-[(4-chlorophenoxy)methyl]-1,3-thiazol-5-yl]methanol?
The IUPAC name of [2-[(4-chlorophenoxy)methyl]-1,3-thiazol-5-yl]methanol (CID 82190969) is [2-[(4-chlorophenoxy)methyl]-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for [2-[(4-chlorophenoxy)methyl]-1,3-thiazol-5-yl]methanol?
The canonical SMILES for [2-[(4-chlorophenoxy)methyl]-1,3-thiazol-5-yl]methanol is OCc1cnc(COc2ccc(Cl)cc2)s1.
What is the InChIKey of [2-[(4-chlorophenoxy)methyl]-1,3-thiazol-5-yl]methanol?
The InChIKey is NFFFLRGFNQSIAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClNO2S/c12-8-1-3-9(4-2-8)15-7-11-13-5-10(6-14)16-11/h1-5,14H,6-7H2.
What are the key properties of [2-[(4-chlorophenoxy)methyl]-1,3-thiazol-5-yl]methanol?
[2-[(4-chlorophenoxy)methyl]-1,3-thiazol-5-yl]methanol has a molecular weight of 255.73 g/mol, XLogP of 2.87, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(4-chlorophenoxy)methyl]-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 82190969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).