5-bromo-4-(5-bromothiophen-2-yl)-1,3-thiazol-2-amine

C7H4Br2N2S2 — CID 658268

IUPAC5-bromo-4-(5-bromothiophen-2-yl)-1,3-thiazol-2-amine
SMILESNc1nc(-c2ccc(Br)s2)c(Br)s1
InChIInChI=1S/C7H4Br2N2S2/c8-4-2-1-3(12-4)5-6(9)13-7(10)11-5/h1-2H,(H2,10,11)
InChIKeyRXZPMWULQMMBJK-UHFFFAOYSA-N
MW340.07 g/mol
LogP3.98
Rot. Bonds1

About 5-bromo-4-(5-bromothiophen-2-yl)-1,3-thiazol-2-amine

5-bromo-4-(5-bromothiophen-2-yl)-1,3-thiazol-2-amine (PubChem CID 658268) has the molecular formula C7H4Br2N2S2 and a molecular weight of 340.07 g/mol. Its IUPAC name is 5-bromo-4-(5-bromothiophen-2-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-bromo-4-(5-bromothiophen-2-yl)-1,3-thiazol-2-amine
PubChem CID658268
Molecular FormulaC7H4Br2N2S2
Molecular Weight340.07 g/mol
Exact Mass337.82
IUPAC Name5-bromo-4-(5-bromothiophen-2-yl)-1,3-thiazol-2-amine
SMILESNc1nc(-c2ccc(Br)s2)c(Br)s1
InChIInChI=1S/C7H4Br2N2S2/c8-4-2-1-3(12-4)5-6(9)13-7(10)11-5/h1-2H,(H2,10,11)
InChIKeyRXZPMWULQMMBJK-UHFFFAOYSA-N
XLogP3.98
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.07
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-4-(5-bromothiophen-2-yl)-1,3-thiazol-2-amine?
The IUPAC name of 5-bromo-4-(5-bromothiophen-2-yl)-1,3-thiazol-2-amine (CID 658268) is 5-bromo-4-(5-bromothiophen-2-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for 5-bromo-4-(5-bromothiophen-2-yl)-1,3-thiazol-2-amine?
The canonical SMILES for 5-bromo-4-(5-bromothiophen-2-yl)-1,3-thiazol-2-amine is Nc1nc(-c2ccc(Br)s2)c(Br)s1.
What is the InChIKey of 5-bromo-4-(5-bromothiophen-2-yl)-1,3-thiazol-2-amine?
The InChIKey is RXZPMWULQMMBJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4Br2N2S2/c8-4-2-1-3(12-4)5-6(9)13-7(10)11-5/h1-2H,(H2,10,11).
What are the key properties of 5-bromo-4-(5-bromothiophen-2-yl)-1,3-thiazol-2-amine?
5-bromo-4-(5-bromothiophen-2-yl)-1,3-thiazol-2-amine has a molecular weight of 340.07 g/mol, XLogP of 3.98, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-4-(5-bromothiophen-2-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 658268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).