5-(difluoromethoxy)-1,3-thiazole

C4H3F2NOS — CID 154460414

IUPAC5-(difluoromethoxy)-1,3-thiazole
SMILESFC(F)Oc1cncs1
InChIInChI=1S/C4H3F2NOS/c5-4(6)8-3-1-7-2-9-3/h1-2,4H
InChIKeyBASSWTNPKTUTCX-UHFFFAOYSA-N
MW151.14 g/mol
LogP1.74
Rot. Bonds2

About 5-(difluoromethoxy)-1,3-thiazole

5-(difluoromethoxy)-1,3-thiazole (PubChem CID 154460414) has the molecular formula C4H3F2NOS and a molecular weight of 151.14 g/mol. Its IUPAC name is 5-(difluoromethoxy)-1,3-thiazole.

Molecular Properties

Compound Name5-(difluoromethoxy)-1,3-thiazole
PubChem CID154460414
Molecular FormulaC4H3F2NOS
Molecular Weight151.14 g/mol
Exact Mass150.99
IUPAC Name5-(difluoromethoxy)-1,3-thiazole
SMILESFC(F)Oc1cncs1
InChIInChI=1S/C4H3F2NOS/c5-4(6)8-3-1-7-2-9-3/h1-2,4H
InChIKeyBASSWTNPKTUTCX-UHFFFAOYSA-N
XLogP1.74
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.14
LogP ≤ 51.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(difluoromethoxy)-1,3-thiazole?
The IUPAC name of 5-(difluoromethoxy)-1,3-thiazole (CID 154460414) is 5-(difluoromethoxy)-1,3-thiazole.
What is the SMILES notation for 5-(difluoromethoxy)-1,3-thiazole?
The canonical SMILES for 5-(difluoromethoxy)-1,3-thiazole is FC(F)Oc1cncs1.
What is the InChIKey of 5-(difluoromethoxy)-1,3-thiazole?
The InChIKey is BASSWTNPKTUTCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H3F2NOS/c5-4(6)8-3-1-7-2-9-3/h1-2,4H.
What are the key properties of 5-(difluoromethoxy)-1,3-thiazole?
5-(difluoromethoxy)-1,3-thiazole has a molecular weight of 151.14 g/mol, XLogP of 1.74, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(difluoromethoxy)-1,3-thiazole is sourced from PubChem (CID 154460414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).