ethane;2-(1,3-thiazol-5-yl)-1,3-thiazole

C8H10N2S2 — CID 144537709

IUPACethane;2-(1,3-thiazol-5-yl)-1,3-thiazole
SMILESCC.c1csc(-c2cncs2)n1
InChIInChI=1S/C6H4N2S2.C2H6/c1-2-9-6(8-1)5-3-7-4-10-5;1-2/h1-4H;1-2H3
InChIKeyVURWDZMOZZHITK-UHFFFAOYSA-N
MW198.32 g/mol
LogP3.29
Rot. Bonds1

About ethane;2-(1,3-thiazol-5-yl)-1,3-thiazole

ethane;2-(1,3-thiazol-5-yl)-1,3-thiazole (PubChem CID 144537709) has the molecular formula C8H10N2S2 and a molecular weight of 198.32 g/mol. Its IUPAC name is ethane;2-(1,3-thiazol-5-yl)-1,3-thiazole.

Molecular Properties

Compound Nameethane;2-(1,3-thiazol-5-yl)-1,3-thiazole
PubChem CID144537709
Molecular FormulaC8H10N2S2
Molecular Weight198.32 g/mol
Exact Mass198.03
IUPAC Nameethane;2-(1,3-thiazol-5-yl)-1,3-thiazole
SMILESCC.c1csc(-c2cncs2)n1
InChIInChI=1S/C6H4N2S2.C2H6/c1-2-9-6(8-1)5-3-7-4-10-5;1-2/h1-4H;1-2H3
InChIKeyVURWDZMOZZHITK-UHFFFAOYSA-N
XLogP3.29
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.32
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(1,3-thiazol-2-yl)phenyl]-1,3-thiazole
CID 901538
ethane;1-iodo-4-methylbenzene;bis(2-(4-methylphenyl)-1,3-thiazole)
CID 143420197
5-(1,3-thiazol-5-yl)-3H-1,3,4-thiadiazole-2-thione
CID 144617469
ethane;2-[2-(4-fluorophenyl)-1H-imidazol-5-yl]-1,3-thiazole
CID 142178675
ethane;5-phenyl-1,3-thiazole
CID 143177201
2-(1H-pyrazol-4-yl)-1,3-thiazole
CID 20555356
ethane;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole
CID 159901643
2,5-bis[2-(1,3-thiazol-2-yl)-1,3-thiazol-5-yl]-[1,3]thiazolo[5,4-d][1,3]thiazole
CID 86009639
3-(1,3-thiazol-5-yl)pyridin-4-amine
CID 130114568
2-(5-propan-2-ylpyrimidin-4-yl)-1,3-thiazole
CID 58415693
2-(5-propan-2-yl-3-pyridinyl)-1,3-thiazole
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2-(5-bromothiophen-2-yl)-1,3-thiazole
CID 18791073

Frequently Asked Questions

What is the IUPAC name of ethane;2-(1,3-thiazol-5-yl)-1,3-thiazole?
The IUPAC name of ethane;2-(1,3-thiazol-5-yl)-1,3-thiazole (CID 144537709) is ethane;2-(1,3-thiazol-5-yl)-1,3-thiazole.
What is the SMILES notation for ethane;2-(1,3-thiazol-5-yl)-1,3-thiazole?
The canonical SMILES for ethane;2-(1,3-thiazol-5-yl)-1,3-thiazole is CC.c1csc(-c2cncs2)n1.
What is the InChIKey of ethane;2-(1,3-thiazol-5-yl)-1,3-thiazole?
The InChIKey is VURWDZMOZZHITK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4N2S2.C2H6/c1-2-9-6(8-1)5-3-7-4-10-5;1-2/h1-4H;1-2H3.
What are the key properties of ethane;2-(1,3-thiazol-5-yl)-1,3-thiazole?
ethane;2-(1,3-thiazol-5-yl)-1,3-thiazole has a molecular weight of 198.32 g/mol, XLogP of 3.29, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-(1,3-thiazol-5-yl)-1,3-thiazole is sourced from PubChem (CID 144537709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).