3-chloro-5-(2-methoxyphenyl)-1,2-thiazole

C10H8ClNOS — CID 83911216

IUPAC3-chloro-5-(2-methoxyphenyl)-1,2-thiazole
SMILESCOc1ccccc1-c1cc(Cl)ns1
InChIInChI=1S/C10H8ClNOS/c1-13-8-5-3-2-4-7(8)9-6-10(11)12-14-9/h2-6H,1H3
InChIKeyRATOEYMMQMMLQD-UHFFFAOYSA-N
MW225.70 g/mol
LogP3.47
Rot. Bonds2

About 3-chloro-5-(2-methoxyphenyl)-1,2-thiazole

3-chloro-5-(2-methoxyphenyl)-1,2-thiazole (PubChem CID 83911216) has the molecular formula C10H8ClNOS and a molecular weight of 225.70 g/mol. Its IUPAC name is 3-chloro-5-(2-methoxyphenyl)-1,2-thiazole.

Molecular Properties

Compound Name3-chloro-5-(2-methoxyphenyl)-1,2-thiazole
PubChem CID83911216
Molecular FormulaC10H8ClNOS
Molecular Weight225.70 g/mol
Exact Mass225.00
IUPAC Name3-chloro-5-(2-methoxyphenyl)-1,2-thiazole
SMILESCOc1ccccc1-c1cc(Cl)ns1
InChIInChI=1S/C10H8ClNOS/c1-13-8-5-3-2-4-7(8)9-6-10(11)12-14-9/h2-6H,1H3
InChIKeyRATOEYMMQMMLQD-UHFFFAOYSA-N
XLogP3.47
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.70
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-(2-methoxyphenyl)-1,2-thiazole?
The IUPAC name of 3-chloro-5-(2-methoxyphenyl)-1,2-thiazole (CID 83911216) is 3-chloro-5-(2-methoxyphenyl)-1,2-thiazole.
What is the SMILES notation for 3-chloro-5-(2-methoxyphenyl)-1,2-thiazole?
The canonical SMILES for 3-chloro-5-(2-methoxyphenyl)-1,2-thiazole is COc1ccccc1-c1cc(Cl)ns1.
What is the InChIKey of 3-chloro-5-(2-methoxyphenyl)-1,2-thiazole?
The InChIKey is RATOEYMMQMMLQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClNOS/c1-13-8-5-3-2-4-7(8)9-6-10(11)12-14-9/h2-6H,1H3.
What are the key properties of 3-chloro-5-(2-methoxyphenyl)-1,2-thiazole?
3-chloro-5-(2-methoxyphenyl)-1,2-thiazole has a molecular weight of 225.70 g/mol, XLogP of 3.47, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-5-(2-methoxyphenyl)-1,2-thiazole is sourced from PubChem (CID 83911216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).