7-bromo-[1,3]thiazolo[4,5-c]pyridin-2-amine

C6H4BrN3S — CID 112756629

IUPAC7-bromo-[1,3]thiazolo[4,5-c]pyridin-2-amine
SMILESNc1nc2cncc(Br)c2s1
InChIInChI=1S/C6H4BrN3S/c7-3-1-9-2-4-5(3)11-6(8)10-4/h1-2H,(H2,8,10)
InChIKeyHVOUOYWYYBFBMM-UHFFFAOYSA-N
MW230.09 g/mol
LogP2.04
Rot. Bonds

About 7-bromo-[1,3]thiazolo[4,5-c]pyridin-2-amine

7-bromo-[1,3]thiazolo[4,5-c]pyridin-2-amine (PubChem CID 112756629) has the molecular formula C6H4BrN3S and a molecular weight of 230.09 g/mol. Its IUPAC name is 7-bromo-[1,3]thiazolo[4,5-c]pyridin-2-amine.

Molecular Properties

Compound Name7-bromo-[1,3]thiazolo[4,5-c]pyridin-2-amine
PubChem CID112756629
Molecular FormulaC6H4BrN3S
Molecular Weight230.09 g/mol
Exact Mass228.93
IUPAC Name7-bromo-[1,3]thiazolo[4,5-c]pyridin-2-amine
SMILESNc1nc2cncc(Br)c2s1
InChIInChI=1S/C6H4BrN3S/c7-3-1-9-2-4-5(3)11-6(8)10-4/h1-2H,(H2,8,10)
InChIKeyHVOUOYWYYBFBMM-UHFFFAOYSA-N
XLogP2.04
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.09
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 7-bromo-[1,3]thiazolo[4,5-c]pyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-bromo-[1,3]thiazolo[4,5-c]pyridin-2-amine?
The IUPAC name of 7-bromo-[1,3]thiazolo[4,5-c]pyridin-2-amine (CID 112756629) is 7-bromo-[1,3]thiazolo[4,5-c]pyridin-2-amine.
What is the SMILES notation for 7-bromo-[1,3]thiazolo[4,5-c]pyridin-2-amine?
The canonical SMILES for 7-bromo-[1,3]thiazolo[4,5-c]pyridin-2-amine is Nc1nc2cncc(Br)c2s1.
What is the InChIKey of 7-bromo-[1,3]thiazolo[4,5-c]pyridin-2-amine?
The InChIKey is HVOUOYWYYBFBMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4BrN3S/c7-3-1-9-2-4-5(3)11-6(8)10-4/h1-2H,(H2,8,10).
What are the key properties of 7-bromo-[1,3]thiazolo[4,5-c]pyridin-2-amine?
7-bromo-[1,3]thiazolo[4,5-c]pyridin-2-amine has a molecular weight of 230.09 g/mol, XLogP of 2.04, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-[1,3]thiazolo[4,5-c]pyridin-2-amine is sourced from PubChem (CID 112756629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).