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

C15H10Cl2N2S — CID 53338312

IUPAC4-(3-chlorophenyl)-N-(4-chlorophenyl)-1,3-thiazol-2-amine
SMILESClc1ccc(Nc2nc(-c3cccc(Cl)c3)cs2)cc1
InChIInChI=1S/C15H10Cl2N2S/c16-11-4-6-13(7-5-11)18-15-19-14(9-20-15)10-2-1-3-12(17)8-10/h1-9H,(H,18,19)
InChIKeyZQFFQYCPVHPXMK-UHFFFAOYSA-N
MW321.23 g/mol
LogP5.86
Rot. Bonds3

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

4-(3-chlorophenyl)-N-(4-chlorophenyl)-1,3-thiazol-2-amine (PubChem CID 53338312) has the molecular formula C15H10Cl2N2S and a molecular weight of 321.23 g/mol. Its IUPAC name is 4-(3-chlorophenyl)-N-(4-chlorophenyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(3-chlorophenyl)-N-(4-chlorophenyl)-1,3-thiazol-2-amine
PubChem CID53338312
Molecular FormulaC15H10Cl2N2S
Molecular Weight321.23 g/mol
Exact Mass319.99
IUPAC Name4-(3-chlorophenyl)-N-(4-chlorophenyl)-1,3-thiazol-2-amine
SMILESClc1ccc(Nc2nc(-c3cccc(Cl)c3)cs2)cc1
InChIInChI=1S/C15H10Cl2N2S/c16-11-4-6-13(7-5-11)18-15-19-14(9-20-15)10-2-1-3-12(17)8-10/h1-9H,(H,18,19)
InChIKeyZQFFQYCPVHPXMK-UHFFFAOYSA-N
XLogP5.86
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500321.23
LogP ≤ 55.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3-chlorophenyl)-N-(2,4-dichlorophenyl)-1,3-thiazol-2-amine
CID 53338316
N-(4-chlorophenyl)-4-(4-iodophenyl)-1,3-thiazol-2-amine
CID 2193688
N-(4-bromophenyl)-4-(4-chlorophenyl)-1,3-thiazol-2-amine
CID 3551547
N-[3-[2-(4-chloroanilino)-1,3-thiazol-4-yl]phenyl]cyclopropanecarboxamide
CID 42765483
3-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]phenol
CID 877802
4-(3-chlorophenyl)-N-(3-propylsulfanylphenyl)-1,3-thiazol-2-amine
CID 122183985
[4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]phenyl]methanol
CID 118713961
N-[3-[2-(4-chloroanilino)-1,3-thiazol-4-yl]phenyl]-4-methoxybenzamide
CID 5151529
N-[3-[2-(4-chloroanilino)-1,3-thiazol-4-yl]phenyl]octanamide
CID 5216456
4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]benzamide
CID 46880290
3-chloro-N-[4-[(4-pyridin-4-yl-1,3-thiazol-2-yl)amino]phenyl]benzenesulfonamide
CID 110504097
4-N-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]benzene-1,4-diamine
CID 25101049

Frequently Asked Questions

What is the IUPAC name of 4-(3-chlorophenyl)-N-(4-chlorophenyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(3-chlorophenyl)-N-(4-chlorophenyl)-1,3-thiazol-2-amine (CID 53338312) is 4-(3-chlorophenyl)-N-(4-chlorophenyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(3-chlorophenyl)-N-(4-chlorophenyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(3-chlorophenyl)-N-(4-chlorophenyl)-1,3-thiazol-2-amine is Clc1ccc(Nc2nc(-c3cccc(Cl)c3)cs2)cc1.
What is the InChIKey of 4-(3-chlorophenyl)-N-(4-chlorophenyl)-1,3-thiazol-2-amine?
The InChIKey is ZQFFQYCPVHPXMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10Cl2N2S/c16-11-4-6-13(7-5-11)18-15-19-14(9-20-15)10-2-1-3-12(17)8-10/h1-9H,(H,18,19).
What are the key properties of 4-(3-chlorophenyl)-N-(4-chlorophenyl)-1,3-thiazol-2-amine?
4-(3-chlorophenyl)-N-(4-chlorophenyl)-1,3-thiazol-2-amine has a molecular weight of 321.23 g/mol, XLogP of 5.86, 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-(4-chlorophenyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 53338312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).