4-(furan-2-yl)-5-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1,3-thiazole

C15H10N2OS2 — CID 141178004

IUPAC4-(furan-2-yl)-5-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1,3-thiazole
SMILESc1c[nH]c(-c2sc(-c3cccs3)nc2-c2ccco2)c1
InChIInChI=1S/C15H10N2OS2/c1-4-10(16-7-1)14-13(11-5-2-8-18-11)17-15(20-14)12-6-3-9-19-12/h1-9,16H
InChIKeyLCRGNPXDVJDIJO-UHFFFAOYSA-N
MW298.39 g/mol
LogP5.13
Rot. Bonds3

About 4-(furan-2-yl)-5-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1,3-thiazole

4-(furan-2-yl)-5-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1,3-thiazole (PubChem CID 141178004) has the molecular formula C15H10N2OS2 and a molecular weight of 298.39 g/mol. Its IUPAC name is 4-(furan-2-yl)-5-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1,3-thiazole.

Molecular Properties

Compound Name4-(furan-2-yl)-5-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1,3-thiazole
PubChem CID141178004
Molecular FormulaC15H10N2OS2
Molecular Weight298.39 g/mol
Exact Mass298.02
IUPAC Name4-(furan-2-yl)-5-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1,3-thiazole
SMILESc1c[nH]c(-c2sc(-c3cccs3)nc2-c2ccco2)c1
InChIInChI=1S/C15H10N2OS2/c1-4-10(16-7-1)14-13(11-5-2-8-18-11)17-15(20-14)12-6-3-9-19-12/h1-9,16H
InChIKeyLCRGNPXDVJDIJO-UHFFFAOYSA-N
XLogP5.13
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500298.39
LogP ≤ 55.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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2-[2-(Furan-2-yl)-6-[4-(1,3-thiazol-2-yl)phenyl]-4-pyridinyl]-1,3-thiazole
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2-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]-1-(1H-pyrrol-2-yl)ethanone
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2-(furan-2-yl)-3-thiophen-2-yl-1H-pyrrole
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4-(Furan-2-yl)-5-pyridin-2-yl-1,3-thiazol-2-amine
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Frequently Asked Questions

What is the IUPAC name of 4-(furan-2-yl)-5-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1,3-thiazole?
The IUPAC name of 4-(furan-2-yl)-5-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1,3-thiazole (CID 141178004) is 4-(furan-2-yl)-5-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1,3-thiazole.
What is the SMILES notation for 4-(furan-2-yl)-5-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1,3-thiazole?
The canonical SMILES for 4-(furan-2-yl)-5-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1,3-thiazole is c1c[nH]c(-c2sc(-c3cccs3)nc2-c2ccco2)c1.
What is the InChIKey of 4-(furan-2-yl)-5-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1,3-thiazole?
The InChIKey is LCRGNPXDVJDIJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N2OS2/c1-4-10(16-7-1)14-13(11-5-2-8-18-11)17-15(20-14)12-6-3-9-19-12/h1-9,16H.
What are the key properties of 4-(furan-2-yl)-5-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1,3-thiazole?
4-(furan-2-yl)-5-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1,3-thiazole has a molecular weight of 298.39 g/mol, XLogP of 5.13, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(furan-2-yl)-5-(1H-pyrrol-2-yl)-2-thiophen-2-yl-1,3-thiazole is sourced from PubChem (CID 141178004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).