4-chloro-N-(3-chloro-4-methylphenyl)-1,3-thiazol-2-amine

C10H8Cl2N2S — CID 83152094

IUPAC4-chloro-N-(3-chloro-4-methylphenyl)-1,3-thiazol-2-amine
SMILESCc1ccc(Nc2nc(Cl)cs2)cc1Cl
InChIInChI=1S/C10H8Cl2N2S/c1-6-2-3-7(4-8(6)11)13-10-14-9(12)5-15-10/h2-5H,1H3,(H,13,14)
InChIKeySEZYZKUPCHUACY-UHFFFAOYSA-N
MW259.16 g/mol
LogP4.50
Rot. Bonds2

About 4-chloro-N-(3-chloro-4-methylphenyl)-1,3-thiazol-2-amine

4-chloro-N-(3-chloro-4-methylphenyl)-1,3-thiazol-2-amine (PubChem CID 83152094) has the molecular formula C10H8Cl2N2S and a molecular weight of 259.16 g/mol. Its IUPAC name is 4-chloro-N-(3-chloro-4-methylphenyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-chloro-N-(3-chloro-4-methylphenyl)-1,3-thiazol-2-amine
PubChem CID83152094
Molecular FormulaC10H8Cl2N2S
Molecular Weight259.16 g/mol
Exact Mass257.98
IUPAC Name4-chloro-N-(3-chloro-4-methylphenyl)-1,3-thiazol-2-amine
SMILESCc1ccc(Nc2nc(Cl)cs2)cc1Cl
InChIInChI=1S/C10H8Cl2N2S/c1-6-2-3-7(4-8(6)11)13-10-14-9(12)5-15-10/h2-5H,1H3,(H,13,14)
InChIKeySEZYZKUPCHUACY-UHFFFAOYSA-N
XLogP4.50
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.16
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-N-(3-fluoro-4-methylphenyl)-1,3-thiazol-2-amine
CID 83152809
N-(3-chloro-4-methylphenyl)-4-pyridin-4-yl-1,3-thiazol-2-amine
CID 2214320
N-(3-chloro-4-methylphenyl)-4-(3,4-dimethylphenyl)-1,3-thiazol-2-amine;hydrobromide
CID 2859307
N-(3-chloro-4-methylphenyl)-4-(4-propan-2-ylphenyl)-1,3-thiazol-2-amine
CID 23804659
N-(3-chloro-4-methylphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-amine
CID 19132871
methyl 3-[2-(3-chloro-4-methylanilino)-1,3-thiazol-4-yl]propanoate
CID 107039867
4-chloro-N-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazol-2-amine
CID 83152566
N-(3-bromo-4-methoxyphenyl)-4-chloro-1,3-thiazol-2-amine
CID 83156364
4-chloro-N-(2,4-dimethylphenyl)-1,3-thiazol-2-amine
CID 83153410
4-chloro-N-(4-chloro-2-methoxy-5-methylphenyl)-1,3-thiazol-2-amine
CID 83152214
6-chloro-N-(3-chloro-4-methylphenyl)pyridin-2-amine
CID 63585961
N-(5-tert-butyl-1,2-oxazol-3-yl)-2-(3-chloro-4-methylanilino)-1,3-thiazole-4-carboxamide
CID 137372326

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(3-chloro-4-methylphenyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-chloro-N-(3-chloro-4-methylphenyl)-1,3-thiazol-2-amine (CID 83152094) is 4-chloro-N-(3-chloro-4-methylphenyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-chloro-N-(3-chloro-4-methylphenyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-chloro-N-(3-chloro-4-methylphenyl)-1,3-thiazol-2-amine is Cc1ccc(Nc2nc(Cl)cs2)cc1Cl.
What is the InChIKey of 4-chloro-N-(3-chloro-4-methylphenyl)-1,3-thiazol-2-amine?
The InChIKey is SEZYZKUPCHUACY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8Cl2N2S/c1-6-2-3-7(4-8(6)11)13-10-14-9(12)5-15-10/h2-5H,1H3,(H,13,14).
What are the key properties of 4-chloro-N-(3-chloro-4-methylphenyl)-1,3-thiazol-2-amine?
4-chloro-N-(3-chloro-4-methylphenyl)-1,3-thiazol-2-amine has a molecular weight of 259.16 g/mol, XLogP of 4.50, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(3-chloro-4-methylphenyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 83152094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).