N'-(2,4-difluorophenyl)sulfonyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetohydrazide

C13H10F2N4O3S2 — CID 8505191

IUPACN'-(2,4-difluorophenyl)sulfonyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetohydrazide
SMILESO=C(Cc1cn2ccsc2n1)NNS(=O)(=O)c1ccc(F)cc1F
InChIInChI=1S/C13H10F2N4O3S2/c14-8-1-2-11(10(15)5-8)24(21,22)18-17-12(20)6-9-7-19-3-4-23-13(19)16-9/h1-5,7,18H,6H2,(H,17,20)
InChIKeyAOCXCULZRNBRFN-UHFFFAOYSA-N
MW372.38 g/mol
LogP1.23
Rot. Bonds5

About N'-(2,4-difluorophenyl)sulfonyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetohydrazide

N'-(2,4-difluorophenyl)sulfonyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetohydrazide (PubChem CID 8505191) has the molecular formula C13H10F2N4O3S2 and a molecular weight of 372.38 g/mol. Its IUPAC name is N'-(2,4-difluorophenyl)sulfonyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetohydrazide.

Molecular Properties

Compound NameN'-(2,4-difluorophenyl)sulfonyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetohydrazide
PubChem CID8505191
Molecular FormulaC13H10F2N4O3S2
Molecular Weight372.38 g/mol
Exact Mass372.02
IUPAC NameN'-(2,4-difluorophenyl)sulfonyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetohydrazide
SMILESO=C(Cc1cn2ccsc2n1)NNS(=O)(=O)c1ccc(F)cc1F
InChIInChI=1S/C13H10F2N4O3S2/c14-8-1-2-11(10(15)5-8)24(21,22)18-17-12(20)6-9-7-19-3-4-23-13(19)16-9/h1-5,7,18H,6H2,(H,17,20)
InChIKeyAOCXCULZRNBRFN-UHFFFAOYSA-N
XLogP1.23
TPSA92.57 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.38
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N'-(2,4-dimethylphenyl)sulfonyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetohydrazide
CID 8505231
2-imidazo[2,1-b][1,3]thiazol-6-yl-N'-(2,3,4,5,6-pentamethylphenyl)sulfonylacetohydrazide
CID 8505262
5-fluoro-N'-(2-imidazo[2,1-b][1,3]thiazol-6-ylacetyl)-2-methylbenzohydrazide
CID 17411234
2-(4-chlorophenyl)-N'-(2-imidazo[2,1-b][1,3]thiazol-6-ylacetyl)acetohydrazide
CID 27683802
N-[(4R)-6-fluoro-3,4-dihydro-2H-thiochromen-4-yl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
CID 9266743
1-(2-chloro-4-fluorophenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanone
CID 115333102
2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(2,2,2-trifluoroethyl)acetamide
CID 134025216
N-(4-chlorophenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
CID 5057213
N-[4-(3-fluorophenoxy)phenyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
CID 60538380
2-imidazo[2,1-b][1,3]thiazol-6-yl-N-phenylacetamide
CID 4623847
2-bromo-4-fluoro-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)aniline
CID 113288753
2-[(2-imidazo[2,1-b][1,3]thiazol-6-ylacetyl)amino]-2-methylbutanoic acid
CID 79793246

Frequently Asked Questions

What is the IUPAC name of N'-(2,4-difluorophenyl)sulfonyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetohydrazide?
The IUPAC name of N'-(2,4-difluorophenyl)sulfonyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetohydrazide (CID 8505191) is N'-(2,4-difluorophenyl)sulfonyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetohydrazide.
What is the SMILES notation for N'-(2,4-difluorophenyl)sulfonyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetohydrazide?
The canonical SMILES for N'-(2,4-difluorophenyl)sulfonyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetohydrazide is O=C(Cc1cn2ccsc2n1)NNS(=O)(=O)c1ccc(F)cc1F.
What is the InChIKey of N'-(2,4-difluorophenyl)sulfonyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetohydrazide?
The InChIKey is AOCXCULZRNBRFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F2N4O3S2/c14-8-1-2-11(10(15)5-8)24(21,22)18-17-12(20)6-9-7-19-3-4-23-13(19)16-9/h1-5,7,18H,6H2,(H,17,20).
What are the key properties of N'-(2,4-difluorophenyl)sulfonyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetohydrazide?
N'-(2,4-difluorophenyl)sulfonyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetohydrazide has a molecular weight of 372.38 g/mol, XLogP of 1.23, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2,4-difluorophenyl)sulfonyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetohydrazide is sourced from PubChem (CID 8505191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).