2-[(Z)-2-bromoethenyl]-1,3-thiazole

C5H4BrNS — CID 156686178

IUPAC2-[(Z)-2-bromoethenyl]-1,3-thiazole
SMILESBr/C=C\c1nccs1
InChIInChI=1S/C5H4BrNS/c6-2-1-5-7-3-4-8-5/h1-4H/b2-1-
InChIKeySFMIYNKNABKUCF-UPHRSURJSA-N
MW190.07 g/mol
LogP2.51
Rot. Bonds1

About 2-[(Z)-2-bromoethenyl]-1,3-thiazole

2-[(Z)-2-bromoethenyl]-1,3-thiazole (PubChem CID 156686178) has the molecular formula C5H4BrNS and a molecular weight of 190.07 g/mol. Its IUPAC name is 2-[(Z)-2-bromoethenyl]-1,3-thiazole.

Molecular Properties

Compound Name2-[(Z)-2-bromoethenyl]-1,3-thiazole
PubChem CID156686178
Molecular FormulaC5H4BrNS
Molecular Weight190.07 g/mol
Exact Mass188.92
IUPAC Name2-[(Z)-2-bromoethenyl]-1,3-thiazole
SMILESBr/C=C\c1nccs1
InChIInChI=1S/C5H4BrNS/c6-2-1-5-7-3-4-8-5/h1-4H/b2-1-
InChIKeySFMIYNKNABKUCF-UPHRSURJSA-N
XLogP2.51
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.07
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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(E)-N,N-dimethyl-2-(1,3-thiazol-2-yl)ethenamine
CID 90120326
(E)-3-(1,3-thiazol-2-yl)(1,2,3-13C3)prop-2-enoic acid
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2-[(E)-2-(1,3,5-triazin-2-yl)ethenyl]-1,3-thiazole
CID 90277910
2-(1,3-thiazol-2-yl)ethenesulfonamide
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4-(1,3-thiazol-2-yl)but-3-en-2-one
CID 54371892
2-[(E)-2-[6-[(E)-2-(1,3-thiazol-2-yl)ethenyl]-2-pyridinyl]ethenyl]-1,3-thiazole
CID 5471827
2-ethenyl-1,3-thiazole;hydrobromide
CID 173125842
2-[(E)-2-(2-methoxyphenyl)ethenyl]-1,3-thiazole
CID 67827143
(NE)-N-(1,3-thiazol-2-ylmethylidene)hydroxylamine
CID 135407689
2-[(E)-2-(4-methoxyphenyl)ethenyl]-1,3-thiazole
CID 14090876
2-[(E)-2-[2-[(E)-2-(1,3-thiazol-2-yl)ethenyl]-1H-indol-3-yl]ethenyl]-1,3-thiazole
CID 122628108

Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-2-bromoethenyl]-1,3-thiazole?
The IUPAC name of 2-[(Z)-2-bromoethenyl]-1,3-thiazole (CID 156686178) is 2-[(Z)-2-bromoethenyl]-1,3-thiazole.
What is the SMILES notation for 2-[(Z)-2-bromoethenyl]-1,3-thiazole?
The canonical SMILES for 2-[(Z)-2-bromoethenyl]-1,3-thiazole is Br/C=C\c1nccs1.
What is the InChIKey of 2-[(Z)-2-bromoethenyl]-1,3-thiazole?
The InChIKey is SFMIYNKNABKUCF-UPHRSURJSA-N. The full InChI is InChI=1S/C5H4BrNS/c6-2-1-5-7-3-4-8-5/h1-4H/b2-1-.
What are the key properties of 2-[(Z)-2-bromoethenyl]-1,3-thiazole?
2-[(Z)-2-bromoethenyl]-1,3-thiazole has a molecular weight of 190.07 g/mol, XLogP of 2.51, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-2-bromoethenyl]-1,3-thiazole is sourced from PubChem (CID 156686178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).