2-(4-chlorophenyl)-4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole

C15H7Cl2F3N2S — CID 110208677

IUPAC2-(4-chlorophenyl)-4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole
SMILESFC(F)(F)c1cnc(-c2csc(-c3ccc(Cl)cc3)n2)c(Cl)c1
InChIInChI=1S/C15H7Cl2F3N2S/c16-10-3-1-8(2-4-10)14-22-12(7-23-14)13-11(17)5-9(6-21-13)15(18,19)20/h1-7H
InChIKeyHIHJNPDSUCTPJE-UHFFFAOYSA-N
MW375.20 g/mol
LogP6.20
Rot. Bonds2

About 2-(4-chlorophenyl)-4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole

2-(4-chlorophenyl)-4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole (PubChem CID 110208677) has the molecular formula C15H7Cl2F3N2S and a molecular weight of 375.20 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole.

Molecular Properties

Compound Name2-(4-chlorophenyl)-4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole
PubChem CID110208677
Molecular FormulaC15H7Cl2F3N2S
Molecular Weight375.20 g/mol
Exact Mass373.97
IUPAC Name2-(4-chlorophenyl)-4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole
SMILESFC(F)(F)c1cnc(-c2csc(-c3ccc(Cl)cc3)n2)c(Cl)c1
InChIInChI=1S/C15H7Cl2F3N2S/c16-10-3-1-8(2-4-10)14-22-12(7-23-14)13-11(17)5-9(6-21-13)15(18,19)20/h1-7H
InChIKeyHIHJNPDSUCTPJE-UHFFFAOYSA-N
XLogP6.20
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500375.20
LogP ≤ 56.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine
CID 110208879
2-[(4-chlorophenyl)methylsulfonyl]-4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]pyrimidine
CID 71628219
4-(4-chlorophenyl)-2-[6-methoxy-4-(trifluoromethyl)-3-pyridinyl]-1,3-thiazole
CID 2746356
4-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-N-[3-(trifluoromethyl)phenyl]benzamide
CID 4680949
4-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]phenol
CID 1473815
5-[(4-chlorophenyl)sulfonylmethyl]-3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,4-oxadiazole
CID 110208738
4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-2-methylsulfanylpyrimidine
CID 71628469
2-chloro-5-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]benzoyl chloride
CID 19068751
[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]-2-oxoethyl] 2-(4-methylphenyl)-1,3-thiazole-4-carboxylate
CID 27776005
4-chloro-2-(4-chlorophenyl)-1,3-thiazole
CID 83158200
2-chloro-4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]benzoic acid
CID 68945828
4-[4-(2,4-dichlorophenyl)-1,3-thiazol-2-yl]-N-[3-(trifluoromethyl)phenyl]benzamide
CID 5167161

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole?
The IUPAC name of 2-(4-chlorophenyl)-4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole (CID 110208677) is 2-(4-chlorophenyl)-4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole.
What is the SMILES notation for 2-(4-chlorophenyl)-4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole?
The canonical SMILES for 2-(4-chlorophenyl)-4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole is FC(F)(F)c1cnc(-c2csc(-c3ccc(Cl)cc3)n2)c(Cl)c1.
What is the InChIKey of 2-(4-chlorophenyl)-4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole?
The InChIKey is HIHJNPDSUCTPJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H7Cl2F3N2S/c16-10-3-1-8(2-4-10)14-22-12(7-23-14)13-11(17)5-9(6-21-13)15(18,19)20/h1-7H.
What are the key properties of 2-(4-chlorophenyl)-4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole?
2-(4-chlorophenyl)-4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole has a molecular weight of 375.20 g/mol, XLogP of 6.20, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole is sourced from PubChem (CID 110208677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).