(2Z,5Z)-2-[2-(furan-2-yl)-2-oxoethylidene]-5-[[2-(trifluoromethyl)-1,3-thiazol-5-yl]methylidene]-1,3-thiazolidin-4-one

C14H7F3N2O3S2 — CID 166230214

IUPAC(2Z,5Z)-2-[2-(furan-2-yl)-2-oxoethylidene]-5-[[2-(trifluoromethyl)-1,3-thiazol-5-yl]methylidene]-1,3-thiazolidin-4-one
SMILESO=C(/C=c1/[nH]c(=O)/c(=C/c2cnc(C(F)(F)F)s2)s1)c1ccco1
InChIInChI=1S/C14H7F3N2O3S2/c15-14(16,17)13-18-6-7(23-13)4-10-12(21)19-11(24-10)5-8(20)9-2-1-3-22-9/h1-6H,(H,19,21)/b10-4-,11-5-
InChIKeyKOUXLPYBFYRYAK-GGXLTUIBSA-N
MW372.35 g/mol
LogP2.00
Rot. Bonds3

About (2Z,5Z)-2-[2-(furan-2-yl)-2-oxoethylidene]-5-[[2-(trifluoromethyl)-1,3-thiazol-5-yl]methylidene]-1,3-thiazolidin-4-one

(2Z,5Z)-2-[2-(furan-2-yl)-2-oxoethylidene]-5-[[2-(trifluoromethyl)-1,3-thiazol-5-yl]methylidene]-1,3-thiazolidin-4-one (PubChem CID 166230214) has the molecular formula C14H7F3N2O3S2 and a molecular weight of 372.35 g/mol. Its IUPAC name is (2Z,5Z)-2-[2-(furan-2-yl)-2-oxoethylidene]-5-[[2-(trifluoromethyl)-1,3-thiazol-5-yl]methylidene]-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name(2Z,5Z)-2-[2-(furan-2-yl)-2-oxoethylidene]-5-[[2-(trifluoromethyl)-1,3-thiazol-5-yl]methylidene]-1,3-thiazolidin-4-one
PubChem CID166230214
Molecular FormulaC14H7F3N2O3S2
Molecular Weight372.35 g/mol
Exact Mass371.99
IUPAC Name(2Z,5Z)-2-[2-(furan-2-yl)-2-oxoethylidene]-5-[[2-(trifluoromethyl)-1,3-thiazol-5-yl]methylidene]-1,3-thiazolidin-4-one
SMILESO=C(/C=c1/[nH]c(=O)/c(=C/c2cnc(C(F)(F)F)s2)s1)c1ccco1
InChIInChI=1S/C14H7F3N2O3S2/c15-14(16,17)13-18-6-7(23-13)4-10-12(21)19-11(24-10)5-8(20)9-2-1-3-22-9/h1-6H,(H,19,21)/b10-4-,11-5-
InChIKeyKOUXLPYBFYRYAK-GGXLTUIBSA-N
XLogP2.00
TPSA75.96 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.35
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze (2Z,5Z)-2-[2-(furan-2-yl)-2-oxoethylidene]-5-[[2-(trifluoromethyl)-1,3-thiazol-5-yl]methylidene]-1,3-thiazolidin-4-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of (2Z,5Z)-2-[2-(furan-2-yl)-2-oxoethylidene]-5-[[2-(trifluoromethyl)-1,3-thiazol-5-yl]methylidene]-1,3-thiazolidin-4-one?
The IUPAC name of (2Z,5Z)-2-[2-(furan-2-yl)-2-oxoethylidene]-5-[[2-(trifluoromethyl)-1,3-thiazol-5-yl]methylidene]-1,3-thiazolidin-4-one (CID 166230214) is (2Z,5Z)-2-[2-(furan-2-yl)-2-oxoethylidene]-5-[[2-(trifluoromethyl)-1,3-thiazol-5-yl]methylidene]-1,3-thiazolidin-4-one.
What is the SMILES notation for (2Z,5Z)-2-[2-(furan-2-yl)-2-oxoethylidene]-5-[[2-(trifluoromethyl)-1,3-thiazol-5-yl]methylidene]-1,3-thiazolidin-4-one?
The canonical SMILES for (2Z,5Z)-2-[2-(furan-2-yl)-2-oxoethylidene]-5-[[2-(trifluoromethyl)-1,3-thiazol-5-yl]methylidene]-1,3-thiazolidin-4-one is O=C(/C=c1/[nH]c(=O)/c(=C/c2cnc(C(F)(F)F)s2)s1)c1ccco1.
What is the InChIKey of (2Z,5Z)-2-[2-(furan-2-yl)-2-oxoethylidene]-5-[[2-(trifluoromethyl)-1,3-thiazol-5-yl]methylidene]-1,3-thiazolidin-4-one?
The InChIKey is KOUXLPYBFYRYAK-GGXLTUIBSA-N. The full InChI is InChI=1S/C14H7F3N2O3S2/c15-14(16,17)13-18-6-7(23-13)4-10-12(21)19-11(24-10)5-8(20)9-2-1-3-22-9/h1-6H,(H,19,21)/b10-4-,11-5-.
What are the key properties of (2Z,5Z)-2-[2-(furan-2-yl)-2-oxoethylidene]-5-[[2-(trifluoromethyl)-1,3-thiazol-5-yl]methylidene]-1,3-thiazolidin-4-one?
(2Z,5Z)-2-[2-(furan-2-yl)-2-oxoethylidene]-5-[[2-(trifluoromethyl)-1,3-thiazol-5-yl]methylidene]-1,3-thiazolidin-4-one has a molecular weight of 372.35 g/mol, XLogP of 2.00, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z,5Z)-2-[2-(furan-2-yl)-2-oxoethylidene]-5-[[2-(trifluoromethyl)-1,3-thiazol-5-yl]methylidene]-1,3-thiazolidin-4-one is sourced from PubChem (CID 166230214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).