4-chloro-2-(4-chlorophenyl)-1,3-thiazole

C9H5Cl2NS — CID 83158200

IUPAC4-chloro-2-(4-chlorophenyl)-1,3-thiazole
SMILESClc1ccc(-c2nc(Cl)cs2)cc1
InChIInChI=1S/C9H5Cl2NS/c10-7-3-1-6(2-4-7)9-12-8(11)5-13-9/h1-5H
InChIKeyUFCJOWGJDXZCOI-UHFFFAOYSA-N
MW230.12 g/mol
LogP4.12
Rot. Bonds1

About 4-chloro-2-(4-chlorophenyl)-1,3-thiazole

4-chloro-2-(4-chlorophenyl)-1,3-thiazole (PubChem CID 83158200) has the molecular formula C9H5Cl2NS and a molecular weight of 230.12 g/mol. Its IUPAC name is 4-chloro-2-(4-chlorophenyl)-1,3-thiazole.

Molecular Properties

Compound Name4-chloro-2-(4-chlorophenyl)-1,3-thiazole
PubChem CID83158200
Molecular FormulaC9H5Cl2NS
Molecular Weight230.12 g/mol
Exact Mass228.95
IUPAC Name4-chloro-2-(4-chlorophenyl)-1,3-thiazole
SMILESClc1ccc(-c2nc(Cl)cs2)cc1
InChIInChI=1S/C9H5Cl2NS/c10-7-3-1-6(2-4-7)9-12-8(11)5-13-9/h1-5H
InChIKeyUFCJOWGJDXZCOI-UHFFFAOYSA-N
XLogP4.12
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.12
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-chloro-2-(4-propylphenyl)-1,3-thiazole
CID 83158999
4-chloro-2-[4-(difluoromethylsulfanyl)phenyl]-1,3-thiazole
CID 83158313
2-(4-chlorophenyl)-1,3-thiazole-4-carbaldehyde
CID 2115215
[2-(4-chlorophenyl)-1,3-thiazol-4-yl]hydrazine
CID 116892044
4-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]phenol
CID 1473815
4-(4-chlorophenyl)sulfanyl-2-(4-methylphenyl)-1,3-thiazole
CID 2324850
2-(1,3-benzodioxol-5-yl)-4-chloro-1,3-thiazole
CID 116892273
4-chloro-2-(2,6-difluoro-3-methylphenyl)-1,3-thiazole
CID 83158898
4-chloro-2-(3-fluoro-5-methylphenyl)-1,3-thiazole
CID 83157998
4-chloro-2-(2,6-difluorophenyl)-1,3-thiazole
CID 83158211
1-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-2-methylpropan-1-one
CID 58782173
5-(4-chloro-1,3-thiazol-2-yl)-1,3-dihydrobenzimidazol-2-one
CID 116892313

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-(4-chlorophenyl)-1,3-thiazole?
The IUPAC name of 4-chloro-2-(4-chlorophenyl)-1,3-thiazole (CID 83158200) is 4-chloro-2-(4-chlorophenyl)-1,3-thiazole.
What is the SMILES notation for 4-chloro-2-(4-chlorophenyl)-1,3-thiazole?
The canonical SMILES for 4-chloro-2-(4-chlorophenyl)-1,3-thiazole is Clc1ccc(-c2nc(Cl)cs2)cc1.
What is the InChIKey of 4-chloro-2-(4-chlorophenyl)-1,3-thiazole?
The InChIKey is UFCJOWGJDXZCOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5Cl2NS/c10-7-3-1-6(2-4-7)9-12-8(11)5-13-9/h1-5H.
What are the key properties of 4-chloro-2-(4-chlorophenyl)-1,3-thiazole?
4-chloro-2-(4-chlorophenyl)-1,3-thiazole has a molecular weight of 230.12 g/mol, XLogP of 4.12, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-(4-chlorophenyl)-1,3-thiazole is sourced from PubChem (CID 83158200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).