2,3-dibromothieno[3,2-c]pyridine

C7H3Br2NS — CID 626243

IUPAC2,3-dibromothieno[3,2-c]pyridine
SMILESBrc1sc2ccncc2c1Br
InChIInChI=1S/C7H3Br2NS/c8-6-4-3-10-2-1-5(4)11-7(6)9/h1-3H
InChIKeyPRTOYMJPHMGASA-UHFFFAOYSA-N
MW292.98 g/mol
LogP3.82
Rot. Bonds

About 2,3-dibromothieno[3,2-c]pyridine

2,3-dibromothieno[3,2-c]pyridine (PubChem CID 626243) has the molecular formula C7H3Br2NS and a molecular weight of 292.98 g/mol. Its IUPAC name is 2,3-dibromothieno[3,2-c]pyridine.

Molecular Properties

Compound Name2,3-dibromothieno[3,2-c]pyridine
PubChem CID626243
Molecular FormulaC7H3Br2NS
Molecular Weight292.98 g/mol
Exact Mass290.84
IUPAC Name2,3-dibromothieno[3,2-c]pyridine
SMILESBrc1sc2ccncc2c1Br
InChIInChI=1S/C7H3Br2NS/c8-6-4-3-10-2-1-5(4)11-7(6)9/h1-3H
InChIKeyPRTOYMJPHMGASA-UHFFFAOYSA-N
XLogP3.82
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.98
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-dibromothieno[3,2-c]pyridine?
The IUPAC name of 2,3-dibromothieno[3,2-c]pyridine (CID 626243) is 2,3-dibromothieno[3,2-c]pyridine.
What is the SMILES notation for 2,3-dibromothieno[3,2-c]pyridine?
The canonical SMILES for 2,3-dibromothieno[3,2-c]pyridine is Brc1sc2ccncc2c1Br.
What is the InChIKey of 2,3-dibromothieno[3,2-c]pyridine?
The InChIKey is PRTOYMJPHMGASA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H3Br2NS/c8-6-4-3-10-2-1-5(4)11-7(6)9/h1-3H.
What are the key properties of 2,3-dibromothieno[3,2-c]pyridine?
2,3-dibromothieno[3,2-c]pyridine has a molecular weight of 292.98 g/mol, XLogP of 3.82, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dibromothieno[3,2-c]pyridine is sourced from PubChem (CID 626243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).