4-tert-butyl-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzenesulfonamide

C24H25N3O2S — CID 983376

IUPAC4-tert-butyl-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzenesulfonamide
SMILESCc1cccn2cc(-c3cccc(NS(=O)(=O)c4ccc(C(C)(C)C)cc4)c3)nc12
InChIInChI=1S/C24H25N3O2S/c1-17-7-6-14-27-16-22(25-23(17)27)18-8-5-9-20(15-18)26-30(28,29)21-12-10-19(11-13-21)24(2,3)4/h5-16,26H,1-4H3
InChIKeyKMUUMRFGYDGPTH-UHFFFAOYSA-N
MW419.55 g/mol
LogP5.41
Rot. Bonds4

About 4-tert-butyl-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzenesulfonamide

4-tert-butyl-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzenesulfonamide (PubChem CID 983376) has the molecular formula C24H25N3O2S and a molecular weight of 419.55 g/mol. Its IUPAC name is 4-tert-butyl-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzenesulfonamide.

Molecular Properties

Compound Name4-tert-butyl-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzenesulfonamide
PubChem CID983376
Molecular FormulaC24H25N3O2S
Molecular Weight419.55 g/mol
Exact Mass419.17
IUPAC Name4-tert-butyl-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzenesulfonamide
SMILESCc1cccn2cc(-c3cccc(NS(=O)(=O)c4ccc(C(C)(C)C)cc4)c3)nc12
InChIInChI=1S/C24H25N3O2S/c1-17-7-6-14-27-16-22(25-23(17)27)18-8-5-9-20(15-18)26-30(28,29)21-12-10-19(11-13-21)24(2,3)4/h5-16,26H,1-4H3
InChIKeyKMUUMRFGYDGPTH-UHFFFAOYSA-N
XLogP5.41
TPSA63.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500419.55
LogP ≤ 55.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-4-phenylbenzenesulfonamide
CID 25038187
3-methyl-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzenesulfonamide
CID 4232154
N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]cyclopropanesulfonamide
CID 122284339
2-methoxy-5-methyl-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzenesulfonamide
CID 122284192
1-ethyl-3,5-dimethyl-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]pyrazole-4-sulfonamide
CID 122284373
2-(2,6-dioxopiperidin-1-yl)-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]ethanesulfonamide
CID 122284330
4-tert-butyl-N-[3-(2-methylpyrimidin-4-yl)phenyl]benzenesulfonamide
CID 3856814
N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-4-pyrazol-1-ylbenzenesulfonamide
CID 122284597
8-methyl-2-(3-pyrrolidin-1-ylsulfonylphenyl)imidazo[1,2-a]pyridine
CID 935997
4-ethoxy-N-[2-methyl-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzenesulfonamide
CID 23608343
N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]cyclopropanecarboxamide
CID 122284189
N-(3-imidazo[1,2-a]pyrimidin-2-ylphenyl)-4-nitrobenzenesulfonamide
CID 2981233

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzenesulfonamide?
The IUPAC name of 4-tert-butyl-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzenesulfonamide (CID 983376) is 4-tert-butyl-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzenesulfonamide.
What is the SMILES notation for 4-tert-butyl-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzenesulfonamide?
The canonical SMILES for 4-tert-butyl-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzenesulfonamide is Cc1cccn2cc(-c3cccc(NS(=O)(=O)c4ccc(C(C)(C)C)cc4)c3)nc12.
What is the InChIKey of 4-tert-butyl-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzenesulfonamide?
The InChIKey is KMUUMRFGYDGPTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O2S/c1-17-7-6-14-27-16-22(25-23(17)27)18-8-5-9-20(15-18)26-30(28,29)21-12-10-19(11-13-21)24(2,3)4/h5-16,26H,1-4H3.
What are the key properties of 4-tert-butyl-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzenesulfonamide?
4-tert-butyl-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzenesulfonamide has a molecular weight of 419.55 g/mol, XLogP of 5.41, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzenesulfonamide is sourced from PubChem (CID 983376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).