6-chloro-N-(furan-3-ylmethyl)-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide

C11H10ClN3O3S2 — CID 61422810

IUPAC6-chloro-N-(furan-3-ylmethyl)-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide
SMILESCN(Cc1ccoc1)S(=O)(=O)c1c(Cl)nc2sccn12
InChIInChI=1S/C11H10ClN3O3S2/c1-14(6-8-2-4-18-7-8)20(16,17)10-9(12)13-11-15(10)3-5-19-11/h2-5,7H,6H2,1H3
InChIKeySUWKGEUARKLUHT-UHFFFAOYSA-N
MW331.81 g/mol
LogP2.46
Rot. Bonds4

About 6-chloro-N-(furan-3-ylmethyl)-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide

6-chloro-N-(furan-3-ylmethyl)-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide (PubChem CID 61422810) has the molecular formula C11H10ClN3O3S2 and a molecular weight of 331.81 g/mol. Its IUPAC name is 6-chloro-N-(furan-3-ylmethyl)-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide.

Molecular Properties

Compound Name6-chloro-N-(furan-3-ylmethyl)-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide
PubChem CID61422810
Molecular FormulaC11H10ClN3O3S2
Molecular Weight331.81 g/mol
Exact Mass330.99
IUPAC Name6-chloro-N-(furan-3-ylmethyl)-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide
SMILESCN(Cc1ccoc1)S(=O)(=O)c1c(Cl)nc2sccn12
InChIInChI=1S/C11H10ClN3O3S2/c1-14(6-8-2-4-18-7-8)20(16,17)10-9(12)13-11-15(10)3-5-19-11/h2-5,7H,6H2,1H3
InChIKeySUWKGEUARKLUHT-UHFFFAOYSA-N
XLogP2.46
TPSA67.82 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.81
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(furan-3-ylmethyl)-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide?
The IUPAC name of 6-chloro-N-(furan-3-ylmethyl)-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide (CID 61422810) is 6-chloro-N-(furan-3-ylmethyl)-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide.
What is the SMILES notation for 6-chloro-N-(furan-3-ylmethyl)-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide?
The canonical SMILES for 6-chloro-N-(furan-3-ylmethyl)-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide is CN(Cc1ccoc1)S(=O)(=O)c1c(Cl)nc2sccn12.
What is the InChIKey of 6-chloro-N-(furan-3-ylmethyl)-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide?
The InChIKey is SUWKGEUARKLUHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClN3O3S2/c1-14(6-8-2-4-18-7-8)20(16,17)10-9(12)13-11-15(10)3-5-19-11/h2-5,7H,6H2,1H3.
What are the key properties of 6-chloro-N-(furan-3-ylmethyl)-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide?
6-chloro-N-(furan-3-ylmethyl)-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide has a molecular weight of 331.81 g/mol, XLogP of 2.46, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(furan-3-ylmethyl)-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide is sourced from PubChem (CID 61422810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).