4-bromo-5-(difluoromethoxy)thieno[2,3-b]pyridine

C8H4BrF2NOS — CID 171547735

IUPAC4-bromo-5-(difluoromethoxy)thieno[2,3-b]pyridine
SMILESFC(F)Oc1cnc2sccc2c1Br
InChIInChI=1S/C8H4BrF2NOS/c9-6-4-1-2-14-7(4)12-3-5(6)13-8(10)11/h1-3,8H
InChIKeyFUVPVPKIRJIFEY-UHFFFAOYSA-N
MW280.09 g/mol
LogP3.66
Rot. Bonds2

About 4-bromo-5-(difluoromethoxy)thieno[2,3-b]pyridine

4-bromo-5-(difluoromethoxy)thieno[2,3-b]pyridine (PubChem CID 171547735) has the molecular formula C8H4BrF2NOS and a molecular weight of 280.09 g/mol. Its IUPAC name is 4-bromo-5-(difluoromethoxy)thieno[2,3-b]pyridine.

Molecular Properties

Compound Name4-bromo-5-(difluoromethoxy)thieno[2,3-b]pyridine
PubChem CID171547735
Molecular FormulaC8H4BrF2NOS
Molecular Weight280.09 g/mol
Exact Mass278.92
IUPAC Name4-bromo-5-(difluoromethoxy)thieno[2,3-b]pyridine
SMILESFC(F)Oc1cnc2sccc2c1Br
InChIInChI=1S/C8H4BrF2NOS/c9-6-4-1-2-14-7(4)12-3-5(6)13-8(10)11/h1-3,8H
InChIKeyFUVPVPKIRJIFEY-UHFFFAOYSA-N
XLogP3.66
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.09
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[4-(difluoromethoxy)phenyl]methyl]thieno[2,3-d]pyrimidin-4-amine
CID 17393154
2-chloro-N-[2-(difluoromethoxy)phenyl]thieno[2,3-d]pyrimidin-4-amine
CID 103320319
1-chloro-4-(difluoromethoxy)isoquinoline
CID 150576638
4-chloro-5-fluorothieno[2,3-b]pyridine
CID 148533768
N-[(1S)-1-[4-(difluoromethoxy)phenyl]propyl]thieno[2,3-d]pyrimidin-4-amine
CID 100938418
thieno[2,3-b]pyridine-4,5-diamine
CID 14207945
2-[3-(difluoromethoxy)thiophen-2-yl]-1,3-thiazole-5-carbaldehyde
CID 178133316
methyl 4-bromo-8-(difluoromethoxy)quinoline-3-carboxylate
CID 102614445
5-(5-propan-2-ylthieno[2,3-b]pyridin-4-yl)oxypyrimidine-2,4-diamine
CID 166005304
4-methoxythieno[2,3-b]pyridin-5-amine
CID 84657451
2,3-dibromo-1-(difluoromethoxy)-4-iodobenzene
CID 118819083
5-bromo-4-piperidin-1-ylthieno[2,3-b]pyridine
CID 156747131

Frequently Asked Questions

What is the IUPAC name of 4-bromo-5-(difluoromethoxy)thieno[2,3-b]pyridine?
The IUPAC name of 4-bromo-5-(difluoromethoxy)thieno[2,3-b]pyridine (CID 171547735) is 4-bromo-5-(difluoromethoxy)thieno[2,3-b]pyridine.
What is the SMILES notation for 4-bromo-5-(difluoromethoxy)thieno[2,3-b]pyridine?
The canonical SMILES for 4-bromo-5-(difluoromethoxy)thieno[2,3-b]pyridine is FC(F)Oc1cnc2sccc2c1Br.
What is the InChIKey of 4-bromo-5-(difluoromethoxy)thieno[2,3-b]pyridine?
The InChIKey is FUVPVPKIRJIFEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H4BrF2NOS/c9-6-4-1-2-14-7(4)12-3-5(6)13-8(10)11/h1-3,8H.
What are the key properties of 4-bromo-5-(difluoromethoxy)thieno[2,3-b]pyridine?
4-bromo-5-(difluoromethoxy)thieno[2,3-b]pyridine has a molecular weight of 280.09 g/mol, XLogP of 3.66, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-5-(difluoromethoxy)thieno[2,3-b]pyridine is sourced from PubChem (CID 171547735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).