[4-[2-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]azanide

C10H5F4N2S- — CID 157234395

IUPAC[4-[2-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]azanide
SMILES[NH-]c1nc(-c2cccc(C(F)(F)F)c2F)cs1
InChIInChI=1S/C10H5F4N2S/c11-8-5(7-4-17-9(15)16-7)2-1-3-6(8)10(12,13)14/h1-4H,(H-,15,16)/q-1
InChIKeyAULUHXTVLSKNIG-UHFFFAOYSA-N
MW261.22 g/mol
LogP4.65
Rot. Bonds1

About [4-[2-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]azanide

[4-[2-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]azanide (PubChem CID 157234395) has the molecular formula C10H5F4N2S- and a molecular weight of 261.22 g/mol. Its IUPAC name is [4-[2-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]azanide.

Molecular Properties

Compound Name[4-[2-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]azanide
PubChem CID157234395
Molecular FormulaC10H5F4N2S-
Molecular Weight261.22 g/mol
Exact Mass261.01
IUPAC Name[4-[2-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]azanide
SMILES[NH-]c1nc(-c2cccc(C(F)(F)F)c2F)cs1
InChIInChI=1S/C10H5F4N2S/c11-8-5(7-4-17-9(15)16-7)2-1-3-6(8)10(12,13)14/h1-4H,(H-,15,16)/q-1
InChIKeyAULUHXTVLSKNIG-UHFFFAOYSA-N
XLogP4.65
TPSA36.69 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.22
LogP ≤ 54.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-[2-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]-4-iodobenzamide
CID 86232371
N-[4-[2-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]-4-(3H-1,2,4-triazin-2-ylamino)benzamide
CID 87740028
N-[4-[2-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]-2-(3-methyl-2,4-dioxo-1H-thieno[2,3-d]pyrimidin-5-yl)acetamide
CID 89028073
1-[4-[4-[2-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]piperazin-1-yl]ethanone
CID 126758636
N-propan-2-yl-4-[2-(trifluoromethyl)phenyl]-1,3-thiazol-2-amine
CID 55154372
2-(4-methoxyphenyl)-4-[2-(trifluoromethyl)phenyl]-1,3-thiazole
CID 162536924
4-chloro-6-[2-fluoro-3-(trifluoromethyl)phenyl]-1,3,5-triazin-2-amine
CID 83240914
1-[3-chloro-5-[[4-[2-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]carbamoyl]-2-pyridinyl]-4-hydroxypiperidine-4-carboxylic acid
CID 87861238
2-[2-fluoro-3-(trifluoromethyl)phenyl]-5-iodo-1,3,4-oxadiazole
CID 114771699
2-[2-fluoro-3-(trifluoromethyl)phenyl]-1H-imidazole
CID 70028778
5-chloro-N-[4-[2-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]-6-(4-pyrrolidin-1-ylpiperidin-1-yl)pyridine-3-carboxamide
CID 15950163
3-(2-chloro-6-fluorophenyl)-5-[5-[2-fluoro-3-(trifluoromethyl)phenyl]-4-methylthiophen-3-yl]-1-methyl-1,2,4-triazole
CID 22065124

Frequently Asked Questions

What is the IUPAC name of [4-[2-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]azanide?
The IUPAC name of [4-[2-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]azanide (CID 157234395) is [4-[2-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]azanide.
What is the SMILES notation for [4-[2-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]azanide?
The canonical SMILES for [4-[2-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]azanide is [NH-]c1nc(-c2cccc(C(F)(F)F)c2F)cs1.
What is the InChIKey of [4-[2-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]azanide?
The InChIKey is AULUHXTVLSKNIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H5F4N2S/c11-8-5(7-4-17-9(15)16-7)2-1-3-6(8)10(12,13)14/h1-4H,(H-,15,16)/q-1.
What are the key properties of [4-[2-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]azanide?
[4-[2-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]azanide has a molecular weight of 261.22 g/mol, XLogP of 4.65, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[2-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]azanide is sourced from PubChem (CID 157234395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).