6-chloro-2-methylimidazo[2,1-b][1,3]thiazole-5-sulfonyl chloride

C6H4Cl2N2O2S2 — CID 129451365

IUPAC6-chloro-2-methylimidazo[2,1-b][1,3]thiazole-5-sulfonyl chloride
SMILESCc1cn2c(S(=O)(=O)Cl)c(Cl)nc2s1
InChIInChI=1S/C6H4Cl2N2O2S2/c1-3-2-10-5(14(8,11)12)4(7)9-6(10)13-3/h2H,1H3
InChIKeyKCNAMEUVMGGRNE-UHFFFAOYSA-N
MW271.15 g/mol
LogP2.29
Rot. Bonds1

About 6-chloro-2-methylimidazo[2,1-b][1,3]thiazole-5-sulfonyl chloride

6-chloro-2-methylimidazo[2,1-b][1,3]thiazole-5-sulfonyl chloride (PubChem CID 129451365) has the molecular formula C6H4Cl2N2O2S2 and a molecular weight of 271.15 g/mol. Its IUPAC name is 6-chloro-2-methylimidazo[2,1-b][1,3]thiazole-5-sulfonyl chloride.

Molecular Properties

Compound Name6-chloro-2-methylimidazo[2,1-b][1,3]thiazole-5-sulfonyl chloride
PubChem CID129451365
Molecular FormulaC6H4Cl2N2O2S2
Molecular Weight271.15 g/mol
Exact Mass269.91
IUPAC Name6-chloro-2-methylimidazo[2,1-b][1,3]thiazole-5-sulfonyl chloride
SMILESCc1cn2c(S(=O)(=O)Cl)c(Cl)nc2s1
InChIInChI=1S/C6H4Cl2N2O2S2/c1-3-2-10-5(14(8,11)12)4(7)9-6(10)13-3/h2H,1H3
InChIKeyKCNAMEUVMGGRNE-UHFFFAOYSA-N
XLogP2.29
TPSA51.44 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.15
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-methylimidazo[2,1-b][1,3]thiazole-5-sulfonyl chloride?
The IUPAC name of 6-chloro-2-methylimidazo[2,1-b][1,3]thiazole-5-sulfonyl chloride (CID 129451365) is 6-chloro-2-methylimidazo[2,1-b][1,3]thiazole-5-sulfonyl chloride.
What is the SMILES notation for 6-chloro-2-methylimidazo[2,1-b][1,3]thiazole-5-sulfonyl chloride?
The canonical SMILES for 6-chloro-2-methylimidazo[2,1-b][1,3]thiazole-5-sulfonyl chloride is Cc1cn2c(S(=O)(=O)Cl)c(Cl)nc2s1.
What is the InChIKey of 6-chloro-2-methylimidazo[2,1-b][1,3]thiazole-5-sulfonyl chloride?
The InChIKey is KCNAMEUVMGGRNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4Cl2N2O2S2/c1-3-2-10-5(14(8,11)12)4(7)9-6(10)13-3/h2H,1H3.
What are the key properties of 6-chloro-2-methylimidazo[2,1-b][1,3]thiazole-5-sulfonyl chloride?
6-chloro-2-methylimidazo[2,1-b][1,3]thiazole-5-sulfonyl chloride has a molecular weight of 271.15 g/mol, XLogP of 2.29, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-methylimidazo[2,1-b][1,3]thiazole-5-sulfonyl chloride is sourced from PubChem (CID 129451365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).