2-(1H-imidazol-2-yl)-4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazole

C19H12F3N3OS — CID 135537663

IUPAC2-(1H-imidazol-2-yl)-4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazole
SMILESFC(F)(F)Oc1ccccc1-c1cccc(-c2csc(-c3ncc[nH]3)n2)c1
InChIInChI=1S/C19H12F3N3OS/c20-19(21,22)26-16-7-2-1-6-14(16)12-4-3-5-13(10-12)15-11-27-18(25-15)17-23-8-9-24-17/h1-11H,(H,23,24)
InChIKeyHWRMYPUFBYOFPO-UHFFFAOYSA-N
MW387.39 g/mol
LogP5.77
Rot. Bonds4

About 2-(1H-imidazol-2-yl)-4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazole

2-(1H-imidazol-2-yl)-4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazole (PubChem CID 135537663) has the molecular formula C19H12F3N3OS and a molecular weight of 387.39 g/mol. Its IUPAC name is 2-(1H-imidazol-2-yl)-4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazole.

Molecular Properties

Compound Name2-(1H-imidazol-2-yl)-4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazole
PubChem CID135537663
Molecular FormulaC19H12F3N3OS
Molecular Weight387.39 g/mol
Exact Mass387.07
IUPAC Name2-(1H-imidazol-2-yl)-4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazole
SMILESFC(F)(F)Oc1ccccc1-c1cccc(-c2csc(-c3ncc[nH]3)n2)c1
InChIInChI=1S/C19H12F3N3OS/c20-19(21,22)26-16-7-2-1-6-14(16)12-4-3-5-13(10-12)15-11-27-18(25-15)17-23-8-9-24-17/h1-11H,(H,23,24)
InChIKeyHWRMYPUFBYOFPO-UHFFFAOYSA-N
XLogP5.77
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500387.39
LogP ≤ 55.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-Methoxyphenyl)-2-(4(5)-methyl-5(4)-imidazolylmethyl)thiazole
CID 3035572
4-(2-ethoxyphenyl)-2-[(5-methyl-1H-imidazol-4-yl)methyl]-1,3-thiazole
CID 14742529
2-(1H-imidazol-5-ylmethyl)-4-(2-methoxyphenyl)-1,3-thiazole
CID 14742546
4-(3-methoxyphenyl)-2-[(5-methyl-1H-imidazol-4-yl)methyl]-1,3-thiazole
CID 14742534
4-(1-methoxynaphthalen-2-yl)-2-[(5-methyl-1H-imidazol-4-yl)methyl]-1,3-thiazole
CID 14742541
4-(2-methoxynaphthalen-1-yl)-2-[(5-methyl-1H-imidazol-4-yl)methyl]-1,3-thiazole
CID 14742542
N-[[5-[2-[[N'-[2-(2-methoxyphenyl)ethyl]carbamimidoyl]amino]-1,3-thiazol-4-yl]-1H-imidazol-2-yl]methyl]acetamide
CID 11004203
2-Pyrimidin-2-yl-4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazole
CID 11486379
2-[(1-Benzylimidazol-2-yl)methyl]-4-(2,5-dimethoxyphenyl)-1,3-thiazole
CID 45915616
4-{[5-(2-fluoro-6-methoxyphenyl)-4-phenyl-1H-imidazol-1-yl]methyl}-1,3-thiazol-2-amine
CID 50972717
N-(1,3-thiazol-2-yl)-4-[5-[[3-(trifluoromethoxy)phenyl]methyl]-1H-imidazol-2-yl]benzenesulfonamide
CID 16039927
N-[4-[5-(1H-imidazol-2-yl)-4-[3-(trifluoromethoxy)phenyl]-1,3-thiazol-2-yl]pyridin-2-yl]acetamide
CID 58095084

Frequently Asked Questions

What is the IUPAC name of 2-(1H-imidazol-2-yl)-4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazole?
The IUPAC name of 2-(1H-imidazol-2-yl)-4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazole (CID 135537663) is 2-(1H-imidazol-2-yl)-4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazole.
What is the SMILES notation for 2-(1H-imidazol-2-yl)-4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazole?
The canonical SMILES for 2-(1H-imidazol-2-yl)-4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazole is FC(F)(F)Oc1ccccc1-c1cccc(-c2csc(-c3ncc[nH]3)n2)c1.
What is the InChIKey of 2-(1H-imidazol-2-yl)-4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazole?
The InChIKey is HWRMYPUFBYOFPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12F3N3OS/c20-19(21,22)26-16-7-2-1-6-14(16)12-4-3-5-13(10-12)15-11-27-18(25-15)17-23-8-9-24-17/h1-11H,(H,23,24).
What are the key properties of 2-(1H-imidazol-2-yl)-4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazole?
2-(1H-imidazol-2-yl)-4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazole has a molecular weight of 387.39 g/mol, XLogP of 5.77, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-imidazol-2-yl)-4-[3-[2-(trifluoromethoxy)phenyl]phenyl]-1,3-thiazole is sourced from PubChem (CID 135537663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).