[2-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-5-yl]methanol

C8H5Cl2NOS2 — CID 130713176

IUPAC[2-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-5-yl]methanol
SMILESOCc1cnc(-c2cc(Cl)sc2Cl)s1
InChIInChI=1S/C8H5Cl2NOS2/c9-6-1-5(7(10)14-6)8-11-2-4(3-12)13-8/h1-2,12H,3H2
InChIKeyWYBAOSFLGFKENU-UHFFFAOYSA-N
MW266.17 g/mol
LogP3.67
Rot. Bonds2

About [2-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-5-yl]methanol

[2-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-5-yl]methanol (PubChem CID 130713176) has the molecular formula C8H5Cl2NOS2 and a molecular weight of 266.17 g/mol. Its IUPAC name is [2-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name[2-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-5-yl]methanol
PubChem CID130713176
Molecular FormulaC8H5Cl2NOS2
Molecular Weight266.17 g/mol
Exact Mass264.92
IUPAC Name[2-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-5-yl]methanol
SMILESOCc1cnc(-c2cc(Cl)sc2Cl)s1
InChIInChI=1S/C8H5Cl2NOS2/c9-6-1-5(7(10)14-6)8-11-2-4(3-12)13-8/h1-2,12H,3H2
InChIKeyWYBAOSFLGFKENU-UHFFFAOYSA-N
XLogP3.67
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.17
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-Thiophen-3-yl-1,3-thiazol-5-yl)methanol
CID 19744530
[2-(5-Chlorothiophen-2-yl)-1,3-thiazol-5-yl]methanol
CID 65575702
1-(2-Thiophen-3-yl-1,3-thiazol-5-yl)ethanol
CID 62653207
[2-(4-Chlorothiophen-2-yl)-1,3-thiazol-5-yl]methanol
CID 79427563
[2-(4-Methylthiophen-3-yl)-1,3-thiazol-5-yl]methanol
CID 80228032
1-[2-(4-Methylthiophen-3-yl)-1,3-thiazol-5-yl]ethanol
CID 80228842
[2-(2-Chlorothiophen-3-yl)-1,3-thiazol-5-yl]methanol
CID 130631222
2-(2,5-Dichlorothiophen-3-yl)-1,3-thiazole-5-carbaldehyde
CID 130655979
2-(2,5-Dichlorothiophen-3-yl)-1,3-thiazole-5-carboxylic acid
CID 131048966

Frequently Asked Questions

What is the IUPAC name of [2-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-5-yl]methanol?
The IUPAC name of [2-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-5-yl]methanol (CID 130713176) is [2-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for [2-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-5-yl]methanol?
The canonical SMILES for [2-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-5-yl]methanol is OCc1cnc(-c2cc(Cl)sc2Cl)s1.
What is the InChIKey of [2-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-5-yl]methanol?
The InChIKey is WYBAOSFLGFKENU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5Cl2NOS2/c9-6-1-5(7(10)14-6)8-11-2-4(3-12)13-8/h1-2,12H,3H2.
What are the key properties of [2-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-5-yl]methanol?
[2-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-5-yl]methanol has a molecular weight of 266.17 g/mol, XLogP of 3.67, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 130713176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).