4-(3-chlorophenyl)-N-(2,4-dichlorophenyl)-1,3-thiazol-2-amine

C15H9Cl3N2S — CID 53338316

IUPAC4-(3-chlorophenyl)-N-(2,4-dichlorophenyl)-1,3-thiazol-2-amine
SMILESClc1cccc(-c2csc(Nc3ccc(Cl)cc3Cl)n2)c1
InChIInChI=1S/C15H9Cl3N2S/c16-10-3-1-2-9(6-10)14-8-21-15(20-14)19-13-5-4-11(17)7-12(13)18/h1-8H,(H,19,20)
InChIKeyIORXOHGRCIEGHI-UHFFFAOYSA-N
MW355.68 g/mol
LogP6.51
Rot. Bonds3

About 4-(3-chlorophenyl)-N-(2,4-dichlorophenyl)-1,3-thiazol-2-amine

4-(3-chlorophenyl)-N-(2,4-dichlorophenyl)-1,3-thiazol-2-amine (PubChem CID 53338316) has the molecular formula C15H9Cl3N2S and a molecular weight of 355.68 g/mol. Its IUPAC name is 4-(3-chlorophenyl)-N-(2,4-dichlorophenyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(3-chlorophenyl)-N-(2,4-dichlorophenyl)-1,3-thiazol-2-amine
PubChem CID53338316
Molecular FormulaC15H9Cl3N2S
Molecular Weight355.68 g/mol
Exact Mass353.96
IUPAC Name4-(3-chlorophenyl)-N-(2,4-dichlorophenyl)-1,3-thiazol-2-amine
SMILESClc1cccc(-c2csc(Nc3ccc(Cl)cc3Cl)n2)c1
InChIInChI=1S/C15H9Cl3N2S/c16-10-3-1-2-9(6-10)14-8-21-15(20-14)19-13-5-4-11(17)7-12(13)18/h1-8H,(H,19,20)
InChIKeyIORXOHGRCIEGHI-UHFFFAOYSA-N
XLogP6.51
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500355.68
LogP ≤ 56.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3-chlorophenyl)-N-(4-chlorophenyl)-1,3-thiazol-2-amine
CID 53338312
N-(2-chloro-4-nitrophenyl)-4-(3-nitrophenyl)-1,3-thiazol-2-amine
CID 57406324
N-[3-[2-(2,4-dichloroanilino)-1,3-thiazol-4-yl]phenyl]-2-methoxybenzamide
CID 3654854
4-(4-aminophenyl)-N-(2,5-dichlorophenyl)-1,3-thiazol-2-amine
CID 810304
N-(2,4-dichlorophenyl)-4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-amine
CID 58496015
N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]benzamide
CID 40596964
4-(3-chlorophenyl)-N-(3-propylsulfanylphenyl)-1,3-thiazol-2-amine
CID 122183985
N-(2-chlorophenyl)-4-[3-(2,4-dichlorophenyl)-1,2-oxazol-5-yl]-1,3-thiazol-2-amine
CID 2745528
N-(2-fluorophenyl)-4-(3-methylphenyl)-1,3-thiazol-2-amine
CID 157269328
N-(2,5-dichlorophenyl)-4-thiophen-2-yl-1,3-thiazol-2-amine
CID 854639
N-(2-chlorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine
CID 1092464
4-naphthalen-2-yl-N-(2,4,6-trichlorophenyl)-1,3-thiazol-2-amine
CID 58911073

Frequently Asked Questions

What is the IUPAC name of 4-(3-chlorophenyl)-N-(2,4-dichlorophenyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(3-chlorophenyl)-N-(2,4-dichlorophenyl)-1,3-thiazol-2-amine (CID 53338316) is 4-(3-chlorophenyl)-N-(2,4-dichlorophenyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(3-chlorophenyl)-N-(2,4-dichlorophenyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(3-chlorophenyl)-N-(2,4-dichlorophenyl)-1,3-thiazol-2-amine is Clc1cccc(-c2csc(Nc3ccc(Cl)cc3Cl)n2)c1.
What is the InChIKey of 4-(3-chlorophenyl)-N-(2,4-dichlorophenyl)-1,3-thiazol-2-amine?
The InChIKey is IORXOHGRCIEGHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9Cl3N2S/c16-10-3-1-2-9(6-10)14-8-21-15(20-14)19-13-5-4-11(17)7-12(13)18/h1-8H,(H,19,20).
What are the key properties of 4-(3-chlorophenyl)-N-(2,4-dichlorophenyl)-1,3-thiazol-2-amine?
4-(3-chlorophenyl)-N-(2,4-dichlorophenyl)-1,3-thiazol-2-amine has a molecular weight of 355.68 g/mol, XLogP of 6.51, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-chlorophenyl)-N-(2,4-dichlorophenyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 53338316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).