6-chloro-5-(3-propylindol-1-yl)sulfonylimidazo[2,1-b][1,3]thiazole

C16H14ClN3O2S2 — CID 142258434

IUPAC6-chloro-5-(3-propylindol-1-yl)sulfonylimidazo[2,1-b][1,3]thiazole
SMILESCCCc1cn(S(=O)(=O)c2c(Cl)nc3sccn23)c2ccccc12
InChIInChI=1S/C16H14ClN3O2S2/c1-2-5-11-10-20(13-7-4-3-6-12(11)13)24(21,22)15-14(17)18-16-19(15)8-9-23-16/h3-4,6-10H,2,5H2,1H3
InChIKeyKQVOMHLCMPGNIR-UHFFFAOYSA-N
MW379.89 g/mol
LogP4.19
Rot. Bonds4

About 6-chloro-5-(3-propylindol-1-yl)sulfonylimidazo[2,1-b][1,3]thiazole

6-chloro-5-(3-propylindol-1-yl)sulfonylimidazo[2,1-b][1,3]thiazole (PubChem CID 142258434) has the molecular formula C16H14ClN3O2S2 and a molecular weight of 379.89 g/mol. Its IUPAC name is 6-chloro-5-(3-propylindol-1-yl)sulfonylimidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name6-chloro-5-(3-propylindol-1-yl)sulfonylimidazo[2,1-b][1,3]thiazole
PubChem CID142258434
Molecular FormulaC16H14ClN3O2S2
Molecular Weight379.89 g/mol
Exact Mass379.02
IUPAC Name6-chloro-5-(3-propylindol-1-yl)sulfonylimidazo[2,1-b][1,3]thiazole
SMILESCCCc1cn(S(=O)(=O)c2c(Cl)nc3sccn23)c2ccccc12
InChIInChI=1S/C16H14ClN3O2S2/c1-2-5-11-10-20(13-7-4-3-6-12(11)13)24(21,22)15-14(17)18-16-19(15)8-9-23-16/h3-4,6-10H,2,5H2,1H3
InChIKeyKQVOMHLCMPGNIR-UHFFFAOYSA-N
XLogP4.19
TPSA56.37 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.89
LogP ≤ 54.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

3-[1-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylindol-3-yl]propan-1-amine
CID 23502991
1-[2-[1-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylindol-3-yl]ethyl]pyrrolidine-2-carboxylic acid
CID 10195602
3-(2-bromoethyl)-1H-indole;5-[3-(2-bromoethyl)indol-1-yl]sulfonyl-6-chloroimidazo[2,1-b][1,3]thiazole;6-chloroimidazo[2,1-b][1,3]thiazole-5-sulfonyl chloride;methane
CID 161078198
2-[5-bromo-1-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylindol-3-yl]ethanamine
CID 10195297
2-[1-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonyl-5-phenylmethoxyindol-3-yl]ethanamine
CID 10238981
2-[1-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonyl-2-methylindol-3-yl]oxy-N,N-diethylethanamine
CID 24989089
1-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonyl-3-(hydroxymethyl)pyrrolidin-3-ol
CID 142309567
7-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonyl-N,N-dimethyl-3,4-dihydro-2H-thiopyrano[2,3-e]indol-2-amine
CID 11396830
5-[2-(4-benzylpiperazin-1-yl)indol-1-yl]sulfonyl-6-chloroimidazo[2,1-b][1,3]thiazole
CID 154452715
6-chloro-N-(2-hydroxyphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 103739497
methyl 4-[5-chloro-1-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylpyrrolo[3,2-b]pyridin-2-yl]butanoate
CID 142783950
6-chloro-5-(2-methylpyrrolidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazole
CID 54882392

Frequently Asked Questions

What is the IUPAC name of 6-chloro-5-(3-propylindol-1-yl)sulfonylimidazo[2,1-b][1,3]thiazole?
The IUPAC name of 6-chloro-5-(3-propylindol-1-yl)sulfonylimidazo[2,1-b][1,3]thiazole (CID 142258434) is 6-chloro-5-(3-propylindol-1-yl)sulfonylimidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 6-chloro-5-(3-propylindol-1-yl)sulfonylimidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 6-chloro-5-(3-propylindol-1-yl)sulfonylimidazo[2,1-b][1,3]thiazole is CCCc1cn(S(=O)(=O)c2c(Cl)nc3sccn23)c2ccccc12.
What is the InChIKey of 6-chloro-5-(3-propylindol-1-yl)sulfonylimidazo[2,1-b][1,3]thiazole?
The InChIKey is KQVOMHLCMPGNIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14ClN3O2S2/c1-2-5-11-10-20(13-7-4-3-6-12(11)13)24(21,22)15-14(17)18-16-19(15)8-9-23-16/h3-4,6-10H,2,5H2,1H3.
What are the key properties of 6-chloro-5-(3-propylindol-1-yl)sulfonylimidazo[2,1-b][1,3]thiazole?
6-chloro-5-(3-propylindol-1-yl)sulfonylimidazo[2,1-b][1,3]thiazole has a molecular weight of 379.89 g/mol, XLogP of 4.19, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-5-(3-propylindol-1-yl)sulfonylimidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 142258434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).