2-[4-(difluoromethoxy)phenyl]-7-(1,3-thiazol-5-yl)furo[3,2-b]pyridine

C17H10F2N2O2S — CID 66780360

IUPAC2-[4-(difluoromethoxy)phenyl]-7-(1,3-thiazol-5-yl)furo[3,2-b]pyridine
SMILESFC(F)Oc1ccc(-c2cc3nccc(-c4cncs4)c3o2)cc1
InChIInChI=1S/C17H10F2N2O2S/c18-17(19)22-11-3-1-10(2-4-11)14-7-13-16(23-14)12(5-6-21-13)15-8-20-9-24-15/h1-9,17H
InChIKeyZRVWOOVMNAZOFO-UHFFFAOYSA-N
MW344.34 g/mol
LogP5.22
Rot. Bonds4

About 2-[4-(difluoromethoxy)phenyl]-7-(1,3-thiazol-5-yl)furo[3,2-b]pyridine

2-[4-(difluoromethoxy)phenyl]-7-(1,3-thiazol-5-yl)furo[3,2-b]pyridine (PubChem CID 66780360) has the molecular formula C17H10F2N2O2S and a molecular weight of 344.34 g/mol. Its IUPAC name is 2-[4-(difluoromethoxy)phenyl]-7-(1,3-thiazol-5-yl)furo[3,2-b]pyridine.

Molecular Properties

Compound Name2-[4-(difluoromethoxy)phenyl]-7-(1,3-thiazol-5-yl)furo[3,2-b]pyridine
PubChem CID66780360
Molecular FormulaC17H10F2N2O2S
Molecular Weight344.34 g/mol
Exact Mass344.04
IUPAC Name2-[4-(difluoromethoxy)phenyl]-7-(1,3-thiazol-5-yl)furo[3,2-b]pyridine
SMILESFC(F)Oc1ccc(-c2cc3nccc(-c4cncs4)c3o2)cc1
InChIInChI=1S/C17H10F2N2O2S/c18-17(19)22-11-3-1-10(2-4-11)14-7-13-16(23-14)12(5-6-21-13)15-8-20-9-24-15/h1-9,17H
InChIKeyZRVWOOVMNAZOFO-UHFFFAOYSA-N
XLogP5.22
TPSA48.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.34
LogP ≤ 55.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(difluoromethoxy)phenyl]-7-(1,3-thiazol-5-yl)furo[3,2-b]pyridine?
The IUPAC name of 2-[4-(difluoromethoxy)phenyl]-7-(1,3-thiazol-5-yl)furo[3,2-b]pyridine (CID 66780360) is 2-[4-(difluoromethoxy)phenyl]-7-(1,3-thiazol-5-yl)furo[3,2-b]pyridine.
What is the SMILES notation for 2-[4-(difluoromethoxy)phenyl]-7-(1,3-thiazol-5-yl)furo[3,2-b]pyridine?
The canonical SMILES for 2-[4-(difluoromethoxy)phenyl]-7-(1,3-thiazol-5-yl)furo[3,2-b]pyridine is FC(F)Oc1ccc(-c2cc3nccc(-c4cncs4)c3o2)cc1.
What is the InChIKey of 2-[4-(difluoromethoxy)phenyl]-7-(1,3-thiazol-5-yl)furo[3,2-b]pyridine?
The InChIKey is ZRVWOOVMNAZOFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H10F2N2O2S/c18-17(19)22-11-3-1-10(2-4-11)14-7-13-16(23-14)12(5-6-21-13)15-8-20-9-24-15/h1-9,17H.
What are the key properties of 2-[4-(difluoromethoxy)phenyl]-7-(1,3-thiazol-5-yl)furo[3,2-b]pyridine?
2-[4-(difluoromethoxy)phenyl]-7-(1,3-thiazol-5-yl)furo[3,2-b]pyridine has a molecular weight of 344.34 g/mol, XLogP of 5.22, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(difluoromethoxy)phenyl]-7-(1,3-thiazol-5-yl)furo[3,2-b]pyridine is sourced from PubChem (CID 66780360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).