1-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylimidazolidin-2-one

C8H7ClN4O3S2 — CID 61215509

IUPAC1-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylimidazolidin-2-one
SMILESO=C1NCCN1S(=O)(=O)c1c(Cl)nc2sccn12
InChIInChI=1S/C8H7ClN4O3S2/c9-5-6(12-3-4-17-8(12)11-5)18(15,16)13-2-1-10-7(13)14/h3-4H,1-2H2,(H,10,14)
InChIKeyGJCQCSDVXAOEER-UHFFFAOYSA-N
MW306.76 g/mol
LogP0.76
Rot. Bonds2

About 1-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylimidazolidin-2-one

1-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylimidazolidin-2-one (PubChem CID 61215509) has the molecular formula C8H7ClN4O3S2 and a molecular weight of 306.76 g/mol. Its IUPAC name is 1-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylimidazolidin-2-one.

Molecular Properties

Compound Name1-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylimidazolidin-2-one
PubChem CID61215509
Molecular FormulaC8H7ClN4O3S2
Molecular Weight306.76 g/mol
Exact Mass305.96
IUPAC Name1-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylimidazolidin-2-one
SMILESO=C1NCCN1S(=O)(=O)c1c(Cl)nc2sccn12
InChIInChI=1S/C8H7ClN4O3S2/c9-5-6(12-3-4-17-8(12)11-5)18(15,16)13-2-1-10-7(13)14/h3-4H,1-2H2,(H,10,14)
InChIKeyGJCQCSDVXAOEER-UHFFFAOYSA-N
XLogP0.76
TPSA83.78 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.76
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylimidazolidin-2-one?
The IUPAC name of 1-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylimidazolidin-2-one (CID 61215509) is 1-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylimidazolidin-2-one.
What is the SMILES notation for 1-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylimidazolidin-2-one?
The canonical SMILES for 1-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylimidazolidin-2-one is O=C1NCCN1S(=O)(=O)c1c(Cl)nc2sccn12.
What is the InChIKey of 1-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylimidazolidin-2-one?
The InChIKey is GJCQCSDVXAOEER-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7ClN4O3S2/c9-5-6(12-3-4-17-8(12)11-5)18(15,16)13-2-1-10-7(13)14/h3-4H,1-2H2,(H,10,14).
What are the key properties of 1-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylimidazolidin-2-one?
1-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylimidazolidin-2-one has a molecular weight of 306.76 g/mol, XLogP of 0.76, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylimidazolidin-2-one is sourced from PubChem (CID 61215509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).