3,4-difluoro-N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)benzamide

C14H11F2N3OS — CID 7150810

IUPAC3,4-difluoro-N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)benzamide
SMILESO=C(NCCc1cn2ccsc2n1)c1ccc(F)c(F)c1
InChIInChI=1S/C14H11F2N3OS/c15-11-2-1-9(7-12(11)16)13(20)17-4-3-10-8-19-5-6-21-14(19)18-10/h1-2,5-8H,3-4H2,(H,17,20)
InChIKeyCTYGPRFHLPKMRK-UHFFFAOYSA-N
MW307.33 g/mol
LogP2.65
Rot. Bonds4

About 3,4-difluoro-N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)benzamide

3,4-difluoro-N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)benzamide (PubChem CID 7150810) has the molecular formula C14H11F2N3OS and a molecular weight of 307.33 g/mol. Its IUPAC name is 3,4-difluoro-N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)benzamide.

Molecular Properties

Compound Name3,4-difluoro-N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)benzamide
PubChem CID7150810
Molecular FormulaC14H11F2N3OS
Molecular Weight307.33 g/mol
Exact Mass307.06
IUPAC Name3,4-difluoro-N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)benzamide
SMILESO=C(NCCc1cn2ccsc2n1)c1ccc(F)c(F)c1
InChIInChI=1S/C14H11F2N3OS/c15-11-2-1-9(7-12(11)16)13(20)17-4-3-10-8-19-5-6-21-14(19)18-10/h1-2,5-8H,3-4H2,(H,17,20)
InChIKeyCTYGPRFHLPKMRK-UHFFFAOYSA-N
XLogP2.65
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.33
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-2,3-dimethylquinoxaline-6-carboxamide
CID 110661566
N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-4-sulfamoylbenzamide
CID 77083416
N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)thiophene-2-carboxamide
CID 5310147
N-[2-(2-imidazo[2,1-b][1,3]thiazol-6-ylethylamino)-2-oxoethyl]benzamide
CID 110661562
1-(4-chloro-3-fluorophenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanone
CID 107996572
1-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-3-propylurea
CID 110661644
3-(1-acetylpiperidin-4-yl)oxy-N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-4-methoxybenzamide
CID 25274455
2-(2,4-dichlorophenoxy)-N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)acetamide
CID 110661578
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-4-methoxybenzamide
CID 3658662
4-acetamido-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)benzamide
CID 134027726
N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-1-methyl-4,5,6,7-tetrahydroindazole-3-carboxamide
CID 118776725
N-[2-(4-fluorophenyl)ethyl]imidazo[2,1-b][1,3]thiazole-6-carboxamide
CID 110852567

Frequently Asked Questions

What is the IUPAC name of 3,4-difluoro-N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)benzamide?
The IUPAC name of 3,4-difluoro-N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)benzamide (CID 7150810) is 3,4-difluoro-N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)benzamide.
What is the SMILES notation for 3,4-difluoro-N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)benzamide?
The canonical SMILES for 3,4-difluoro-N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)benzamide is O=C(NCCc1cn2ccsc2n1)c1ccc(F)c(F)c1.
What is the InChIKey of 3,4-difluoro-N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)benzamide?
The InChIKey is CTYGPRFHLPKMRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F2N3OS/c15-11-2-1-9(7-12(11)16)13(20)17-4-3-10-8-19-5-6-21-14(19)18-10/h1-2,5-8H,3-4H2,(H,17,20).
What are the key properties of 3,4-difluoro-N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)benzamide?
3,4-difluoro-N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)benzamide has a molecular weight of 307.33 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-difluoro-N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)benzamide is sourced from PubChem (CID 7150810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).