[2-(3-fluorophenyl)-1,3-thiazolidin-3-yl]-thiophen-3-ylmethanone

C14H12FNOS2 — CID 86264771

IUPAC[2-(3-fluorophenyl)-1,3-thiazolidin-3-yl]-thiophen-3-ylmethanone
SMILESO=C(c1ccsc1)N1CCSC1c1cccc(F)c1
InChIInChI=1S/C14H12FNOS2/c15-12-3-1-2-10(8-12)14-16(5-7-19-14)13(17)11-4-6-18-9-11/h1-4,6,8-9,14H,5,7H2
InChIKeyWNVXLMOTDRAVTE-UHFFFAOYSA-N
MW293.39 g/mol
LogP3.78
Rot. Bonds2

About [2-(3-fluorophenyl)-1,3-thiazolidin-3-yl]-thiophen-3-ylmethanone

[2-(3-fluorophenyl)-1,3-thiazolidin-3-yl]-thiophen-3-ylmethanone (PubChem CID 86264771) has the molecular formula C14H12FNOS2 and a molecular weight of 293.39 g/mol. Its IUPAC name is [2-(3-fluorophenyl)-1,3-thiazolidin-3-yl]-thiophen-3-ylmethanone.

Molecular Properties

Compound Name[2-(3-fluorophenyl)-1,3-thiazolidin-3-yl]-thiophen-3-ylmethanone
PubChem CID86264771
Molecular FormulaC14H12FNOS2
Molecular Weight293.39 g/mol
Exact Mass293.03
IUPAC Name[2-(3-fluorophenyl)-1,3-thiazolidin-3-yl]-thiophen-3-ylmethanone
SMILESO=C(c1ccsc1)N1CCSC1c1cccc(F)c1
InChIInChI=1S/C14H12FNOS2/c15-12-3-1-2-10(8-12)14-16(5-7-19-14)13(17)11-4-6-18-9-11/h1-4,6,8-9,14H,5,7H2
InChIKeyWNVXLMOTDRAVTE-UHFFFAOYSA-N
XLogP3.78
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.39
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-(3-fluorophenyl)-1,3-thiazolidin-3-yl]-thiophen-3-ylmethanone?
The IUPAC name of [2-(3-fluorophenyl)-1,3-thiazolidin-3-yl]-thiophen-3-ylmethanone (CID 86264771) is [2-(3-fluorophenyl)-1,3-thiazolidin-3-yl]-thiophen-3-ylmethanone.
What is the SMILES notation for [2-(3-fluorophenyl)-1,3-thiazolidin-3-yl]-thiophen-3-ylmethanone?
The canonical SMILES for [2-(3-fluorophenyl)-1,3-thiazolidin-3-yl]-thiophen-3-ylmethanone is O=C(c1ccsc1)N1CCSC1c1cccc(F)c1.
What is the InChIKey of [2-(3-fluorophenyl)-1,3-thiazolidin-3-yl]-thiophen-3-ylmethanone?
The InChIKey is WNVXLMOTDRAVTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12FNOS2/c15-12-3-1-2-10(8-12)14-16(5-7-19-14)13(17)11-4-6-18-9-11/h1-4,6,8-9,14H,5,7H2.
What are the key properties of [2-(3-fluorophenyl)-1,3-thiazolidin-3-yl]-thiophen-3-ylmethanone?
[2-(3-fluorophenyl)-1,3-thiazolidin-3-yl]-thiophen-3-ylmethanone has a molecular weight of 293.39 g/mol, XLogP of 3.78, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-fluorophenyl)-1,3-thiazolidin-3-yl]-thiophen-3-ylmethanone is sourced from PubChem (CID 86264771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).