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

C9H6ClNS — CID 23135786

IUPAC2-(3-chlorophenyl)-1,3-thiazole
SMILESClc1cccc(-c2nccs2)c1
InChIInChI=1S/C9H6ClNS/c10-8-3-1-2-7(6-8)9-11-4-5-12-9/h1-6H
InChIKeyVXHUOXFRQZBAMY-UHFFFAOYSA-N
MW195.67 g/mol
LogP3.46
Rot. Bonds1

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

2-(3-chlorophenyl)-1,3-thiazole (PubChem CID 23135786) has the molecular formula C9H6ClNS and a molecular weight of 195.67 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-1,3-thiazole.

Molecular Properties

Compound Name2-(3-chlorophenyl)-1,3-thiazole
PubChem CID23135786
Molecular FormulaC9H6ClNS
Molecular Weight195.67 g/mol
Exact Mass194.99
IUPAC Name2-(3-chlorophenyl)-1,3-thiazole
SMILESClc1cccc(-c2nccs2)c1
InChIInChI=1S/C9H6ClNS/c10-8-3-1-2-7(6-8)9-11-4-5-12-9/h1-6H
InChIKeyVXHUOXFRQZBAMY-UHFFFAOYSA-N
XLogP3.46
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.67
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-(3-chlorophenyl)-1,3-thiazole 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

2-(3-propan-2-ylphenyl)-1,3-thiazole
CID 22945701
2-[3-[7-[3-(1,3-thiazol-2-yl)phenyl]triphenylen-2-yl]phenyl]-1,3-thiazole
CID 121297684
ethane;N-methyl-3-(1,3-thiazol-2-yl)aniline
CID 143181511
2-[4-(1,3-thiazol-2-yl)phenyl]-1,3-thiazole
CID 901538
N-[1-(3-chlorophenyl)ethyl]-4-(1,3-thiazol-2-yl)aniline
CID 60928680
N,N-dimethyl-1-[3-(1,3-thiazol-2-yl)phenyl]methanamine
CID 173380030
2-(3-prop-2-enylphenyl)-1,3-thiazole
CID 141281428
N-cyclopentyl-3-(1,3-thiazol-2-yl)aniline
CID 54864565
2-[2-[4-(3-chlorophenyl)piperazin-1-yl]-3H-benzimidazol-5-yl]-1,3-thiazole
CID 82563335
N-(3-chlorophenyl)-4-(1,3-thiazol-2-yl)-1,3-thiazol-2-amine
CID 163214642
2-chloro-N-[3-(1,3-thiazol-2-yl)phenyl]pyridine-3-carboxamide
CID 61040465
2-(2,5-diphenylphenyl)-1,3-thiazole
CID 71205549

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-1,3-thiazole?
The IUPAC name of 2-(3-chlorophenyl)-1,3-thiazole (CID 23135786) is 2-(3-chlorophenyl)-1,3-thiazole.
What is the SMILES notation for 2-(3-chlorophenyl)-1,3-thiazole?
The canonical SMILES for 2-(3-chlorophenyl)-1,3-thiazole is Clc1cccc(-c2nccs2)c1.
What is the InChIKey of 2-(3-chlorophenyl)-1,3-thiazole?
The InChIKey is VXHUOXFRQZBAMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6ClNS/c10-8-3-1-2-7(6-8)9-11-4-5-12-9/h1-6H.
What are the key properties of 2-(3-chlorophenyl)-1,3-thiazole?
2-(3-chlorophenyl)-1,3-thiazole has a molecular weight of 195.67 g/mol, XLogP of 3.46, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-1,3-thiazole is sourced from PubChem (CID 23135786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).