7-bromo-2-(4-bromothiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine

C10H6Br2N4S — CID 18313581

IUPAC7-bromo-2-(4-bromothiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine
SMILESNc1cc(Br)cc2nc(-c3cc(Br)cs3)nn12
InChIInChI=1S/C10H6Br2N4S/c11-5-2-8(13)16-9(3-5)14-10(15-16)7-1-6(12)4-17-7/h1-4H,13H2
InChIKeyLJLMDLYEJJKSNT-UHFFFAOYSA-N
MW374.06 g/mol
LogP3.57
Rot. Bonds1

About 7-bromo-2-(4-bromothiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine

7-bromo-2-(4-bromothiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine (PubChem CID 18313581) has the molecular formula C10H6Br2N4S and a molecular weight of 374.06 g/mol. Its IUPAC name is 7-bromo-2-(4-bromothiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine.

Molecular Properties

Compound Name7-bromo-2-(4-bromothiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine
PubChem CID18313581
Molecular FormulaC10H6Br2N4S
Molecular Weight374.06 g/mol
Exact Mass371.87
IUPAC Name7-bromo-2-(4-bromothiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine
SMILESNc1cc(Br)cc2nc(-c3cc(Br)cs3)nn12
InChIInChI=1S/C10H6Br2N4S/c11-5-2-8(13)16-9(3-5)14-10(15-16)7-1-6(12)4-17-7/h1-4H,13H2
InChIKeyLJLMDLYEJJKSNT-UHFFFAOYSA-N
XLogP3.57
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.06
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 7-bromo-2-(4-bromothiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine with MolForge

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Related Compounds

6-Ethylsulfanyl-3-thiophen-2-yl-[1,2,4]triazolo[4,3-b]pyridazine
CID 7190319
3-Bromo-2-methyl-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
CID 1489125
N-[2-(5-bromothiophen-2-yl)ethyl]-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine
CID 26035572
N-[2-(thiophen-2-yl)ethyl]-3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-amine
CID 39313139
2-((3-(Thiophen-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)thio)acetamide
CID 6852074
N-(thiophen-2-ylmethyl)-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine
CID 47135665
N-[(5-bromothiophen-2-yl)methyl]-N-methyl-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine
CID 51301152
N-[(5-bromothiophen-2-yl)methyl]-6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 80048539
N-[(4-bromothiophen-2-yl)methyl]-6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 80049461
N-[(3-bromothiophen-2-yl)methyl]-6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 80480455
N-[2-(5-bromothiophen-2-yl)ethyl]-6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 106048954
7-Bromo-2-thiazol-2-yl-[1,2,4]triazolo[1,5-a]pyridin-5-ylamine
CID 18313557

Frequently Asked Questions

What is the IUPAC name of 7-bromo-2-(4-bromothiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine?
The IUPAC name of 7-bromo-2-(4-bromothiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine (CID 18313581) is 7-bromo-2-(4-bromothiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine.
What is the SMILES notation for 7-bromo-2-(4-bromothiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine?
The canonical SMILES for 7-bromo-2-(4-bromothiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine is Nc1cc(Br)cc2nc(-c3cc(Br)cs3)nn12.
What is the InChIKey of 7-bromo-2-(4-bromothiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine?
The InChIKey is LJLMDLYEJJKSNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Br2N4S/c11-5-2-8(13)16-9(3-5)14-10(15-16)7-1-6(12)4-17-7/h1-4H,13H2.
What are the key properties of 7-bromo-2-(4-bromothiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine?
7-bromo-2-(4-bromothiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine has a molecular weight of 374.06 g/mol, XLogP of 3.57, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-2-(4-bromothiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-5-amine is sourced from PubChem (CID 18313581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).