2-chloro-N-(3-chloro-2-fluoro-6-methoxyphenyl)imidazo[1,2-a]pyridine-3-sulfonamide

C14H10Cl2FN3O3S — CID 167864289

IUPAC2-chloro-N-(3-chloro-2-fluoro-6-methoxyphenyl)imidazo[1,2-a]pyridine-3-sulfonamide
SMILESCOc1ccc(Cl)c(F)c1NS(=O)(=O)c1c(Cl)nc2ccccn12
InChIInChI=1S/C14H10Cl2FN3O3S/c1-23-9-6-5-8(15)11(17)12(9)19-24(21,22)14-13(16)18-10-4-2-3-7-20(10)14/h2-7,19H,1H3
InChIKeyLMCZXTWVFCOPGQ-UHFFFAOYSA-N
MW390.22 g/mol
LogP3.59
Rot. Bonds4

About 2-chloro-N-(3-chloro-2-fluoro-6-methoxyphenyl)imidazo[1,2-a]pyridine-3-sulfonamide

2-chloro-N-(3-chloro-2-fluoro-6-methoxyphenyl)imidazo[1,2-a]pyridine-3-sulfonamide (PubChem CID 167864289) has the molecular formula C14H10Cl2FN3O3S and a molecular weight of 390.22 g/mol. Its IUPAC name is 2-chloro-N-(3-chloro-2-fluoro-6-methoxyphenyl)imidazo[1,2-a]pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-chloro-N-(3-chloro-2-fluoro-6-methoxyphenyl)imidazo[1,2-a]pyridine-3-sulfonamide
PubChem CID167864289
Molecular FormulaC14H10Cl2FN3O3S
Molecular Weight390.22 g/mol
Exact Mass388.98
IUPAC Name2-chloro-N-(3-chloro-2-fluoro-6-methoxyphenyl)imidazo[1,2-a]pyridine-3-sulfonamide
SMILESCOc1ccc(Cl)c(F)c1NS(=O)(=O)c1c(Cl)nc2ccccn12
InChIInChI=1S/C14H10Cl2FN3O3S/c1-23-9-6-5-8(15)11(17)12(9)19-24(21,22)14-13(16)18-10-4-2-3-7-20(10)14/h2-7,19H,1H3
InChIKeyLMCZXTWVFCOPGQ-UHFFFAOYSA-N
XLogP3.59
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.22
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(3-chloro-2-fluoro-6-methoxyphenyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The IUPAC name of 2-chloro-N-(3-chloro-2-fluoro-6-methoxyphenyl)imidazo[1,2-a]pyridine-3-sulfonamide (CID 167864289) is 2-chloro-N-(3-chloro-2-fluoro-6-methoxyphenyl)imidazo[1,2-a]pyridine-3-sulfonamide.
What is the SMILES notation for 2-chloro-N-(3-chloro-2-fluoro-6-methoxyphenyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The canonical SMILES for 2-chloro-N-(3-chloro-2-fluoro-6-methoxyphenyl)imidazo[1,2-a]pyridine-3-sulfonamide is COc1ccc(Cl)c(F)c1NS(=O)(=O)c1c(Cl)nc2ccccn12.
What is the InChIKey of 2-chloro-N-(3-chloro-2-fluoro-6-methoxyphenyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The InChIKey is LMCZXTWVFCOPGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl2FN3O3S/c1-23-9-6-5-8(15)11(17)12(9)19-24(21,22)14-13(16)18-10-4-2-3-7-20(10)14/h2-7,19H,1H3.
What are the key properties of 2-chloro-N-(3-chloro-2-fluoro-6-methoxyphenyl)imidazo[1,2-a]pyridine-3-sulfonamide?
2-chloro-N-(3-chloro-2-fluoro-6-methoxyphenyl)imidazo[1,2-a]pyridine-3-sulfonamide has a molecular weight of 390.22 g/mol, XLogP of 3.59, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(3-chloro-2-fluoro-6-methoxyphenyl)imidazo[1,2-a]pyridine-3-sulfonamide is sourced from PubChem (CID 167864289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).