2-(difluoromethyl)imidazo[2,1-b][1,3,4]thiadiazole

C5H3F2N3S — CID 172788002

IUPAC2-(difluoromethyl)imidazo[2,1-b][1,3,4]thiadiazole
SMILESFC(F)c1nn2ccnc2s1
InChIInChI=1S/C5H3F2N3S/c6-3(7)4-9-10-2-1-8-5(10)11-4/h1-3H
InChIKeyPDZDRRDDPFAMFQ-UHFFFAOYSA-N
MW175.16 g/mol
LogP1.73
Rot. Bonds1

About 2-(difluoromethyl)imidazo[2,1-b][1,3,4]thiadiazole

2-(difluoromethyl)imidazo[2,1-b][1,3,4]thiadiazole (PubChem CID 172788002) has the molecular formula C5H3F2N3S and a molecular weight of 175.16 g/mol. Its IUPAC name is 2-(difluoromethyl)imidazo[2,1-b][1,3,4]thiadiazole.

Molecular Properties

Compound Name2-(difluoromethyl)imidazo[2,1-b][1,3,4]thiadiazole
PubChem CID172788002
Molecular FormulaC5H3F2N3S
Molecular Weight175.16 g/mol
Exact Mass175.00
IUPAC Name2-(difluoromethyl)imidazo[2,1-b][1,3,4]thiadiazole
SMILESFC(F)c1nn2ccnc2s1
InChIInChI=1S/C5H3F2N3S/c6-3(7)4-9-10-2-1-8-5(10)11-4/h1-3H
InChIKeyPDZDRRDDPFAMFQ-UHFFFAOYSA-N
XLogP1.73
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.16
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-Bromoimidazo[2,1-b][1,3,4]thiadiazole
CID 43667923
2-Bromo-5-iodoimidazo[2,1-b][1,3,4]thiadiazole
CID 66221540
6-Chloro-2-methylimidazo[2,1-b][1,3,4]thiadiazole
CID 570967
2,5-Dibromoimidazo[2,1-b][1,3,4]thiadiazole
CID 58285391
2,6-Dibromoimidazo[2,1-b][1,3,4]thiadiazole
CID 67108296
Imidazo(2,1-b)(1,3,4)thiadiazole
CID 18625232
6-Bromo-2-methylimidazo[2,1-b][1,3,4]thiadiazole
CID 177799249
c5-Bromoimidazo[2,1-b][1,3,4]thiadiazole
CID 83679094
2-(Trifluoromethyl)imidazo[2,1-b][1,3,4]thiadiazole
CID 68314856
2-(Trifluoromethyl)-[1,3]thiazolo[3,2-b][1,2,4]triazole
CID 69032394
Trifluoromethyl imidazo[2,1-b][1,3,4]thiadiazole-2-carboxylate
CID 153912370
2-Cyclopropylimidazo[2,1-b][1,3,4]thiadiazole
CID 124013077

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)imidazo[2,1-b][1,3,4]thiadiazole?
The IUPAC name of 2-(difluoromethyl)imidazo[2,1-b][1,3,4]thiadiazole (CID 172788002) is 2-(difluoromethyl)imidazo[2,1-b][1,3,4]thiadiazole.
What is the SMILES notation for 2-(difluoromethyl)imidazo[2,1-b][1,3,4]thiadiazole?
The canonical SMILES for 2-(difluoromethyl)imidazo[2,1-b][1,3,4]thiadiazole is FC(F)c1nn2ccnc2s1.
What is the InChIKey of 2-(difluoromethyl)imidazo[2,1-b][1,3,4]thiadiazole?
The InChIKey is PDZDRRDDPFAMFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H3F2N3S/c6-3(7)4-9-10-2-1-8-5(10)11-4/h1-3H.
What are the key properties of 2-(difluoromethyl)imidazo[2,1-b][1,3,4]thiadiazole?
2-(difluoromethyl)imidazo[2,1-b][1,3,4]thiadiazole has a molecular weight of 175.16 g/mol, XLogP of 1.73, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)imidazo[2,1-b][1,3,4]thiadiazole is sourced from PubChem (CID 172788002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).