2-(benzenesulfonylmethyl)-6-chloroimidazo[1,2-a]pyridine

C14H11ClN2O2S — CID 73354128

IUPAC2-(benzenesulfonylmethyl)-6-chloroimidazo[1,2-a]pyridine
SMILESO=S(=O)(Cc1cn2cc(Cl)ccc2n1)c1ccccc1
InChIInChI=1S/C14H11ClN2O2S/c15-11-6-7-14-16-12(9-17(14)8-11)10-20(18,19)13-4-2-1-3-5-13/h1-9H,10H2
InChIKeyCFAYJNAIRTYKBR-UHFFFAOYSA-N
MW306.77 g/mol
LogP2.96
Rot. Bonds3

About 2-(benzenesulfonylmethyl)-6-chloroimidazo[1,2-a]pyridine

2-(benzenesulfonylmethyl)-6-chloroimidazo[1,2-a]pyridine (PubChem CID 73354128) has the molecular formula C14H11ClN2O2S and a molecular weight of 306.77 g/mol. Its IUPAC name is 2-(benzenesulfonylmethyl)-6-chloroimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-(benzenesulfonylmethyl)-6-chloroimidazo[1,2-a]pyridine
PubChem CID73354128
Molecular FormulaC14H11ClN2O2S
Molecular Weight306.77 g/mol
Exact Mass306.02
IUPAC Name2-(benzenesulfonylmethyl)-6-chloroimidazo[1,2-a]pyridine
SMILESO=S(=O)(Cc1cn2cc(Cl)ccc2n1)c1ccccc1
InChIInChI=1S/C14H11ClN2O2S/c15-11-6-7-14-16-12(9-17(14)8-11)10-20(18,19)13-4-2-1-3-5-13/h1-9H,10H2
InChIKeyCFAYJNAIRTYKBR-UHFFFAOYSA-N
XLogP2.96
TPSA51.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.77
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 14652
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CID 739934
2-fluoro-N-(imidazo[1,2-a]pyridin-2-ylmethyl)benzenesulfonamide
CID 16195005
4-(6-chloroimidazo[1,2-a]pyridin-2-yl)-N,N-diethylbenzenesulfonamide
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6-Chloro-2-(4,6-dimethyl-pyrimidin-2-ylsulfanylmethyl)-imidazo[1,2-a]pyridine
CID 2818406
2-(5-Bromothiophen-2-yl)-6-chloroimidazo[1,2-a]pyridine
CID 3850729
Ethyl 2-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]acetate
CID 4122247
2-(((6-Chloroimidazo[1,2-a]pyridin-2-yl)methyl)thio)acetic acid
CID 4262836
N-(2-{3-[(3-chlorophenyl)sulfonyl]-1H-pyrrolo[2,3-b]pyridin-1-yl}ethyl)-N,N-dimethylamine
CID 10067306
4-chloro-N-[1-(1-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]benzenesulfonamide
CID 59177064
2-(Tert-butylsulfonyl)-6,7,8,9-tetrahydropyrido[1,2-a]benzimidazole
CID 658092

Frequently Asked Questions

What is the IUPAC name of 2-(benzenesulfonylmethyl)-6-chloroimidazo[1,2-a]pyridine?
The IUPAC name of 2-(benzenesulfonylmethyl)-6-chloroimidazo[1,2-a]pyridine (CID 73354128) is 2-(benzenesulfonylmethyl)-6-chloroimidazo[1,2-a]pyridine.
What is the SMILES notation for 2-(benzenesulfonylmethyl)-6-chloroimidazo[1,2-a]pyridine?
The canonical SMILES for 2-(benzenesulfonylmethyl)-6-chloroimidazo[1,2-a]pyridine is O=S(=O)(Cc1cn2cc(Cl)ccc2n1)c1ccccc1.
What is the InChIKey of 2-(benzenesulfonylmethyl)-6-chloroimidazo[1,2-a]pyridine?
The InChIKey is CFAYJNAIRTYKBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClN2O2S/c15-11-6-7-14-16-12(9-17(14)8-11)10-20(18,19)13-4-2-1-3-5-13/h1-9H,10H2.
What are the key properties of 2-(benzenesulfonylmethyl)-6-chloroimidazo[1,2-a]pyridine?
2-(benzenesulfonylmethyl)-6-chloroimidazo[1,2-a]pyridine has a molecular weight of 306.77 g/mol, XLogP of 2.96, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzenesulfonylmethyl)-6-chloroimidazo[1,2-a]pyridine is sourced from PubChem (CID 73354128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).