tert-butyl N-(benzenesulfonyl)-N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)carbamate;tert-butyl N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)carbamate;3-chloro-6-methylimidazo[1,2-a]pyridine-2-carboxylic acid;N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)benzenesulfonamide;N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]benzenesulfonamide;ethane;ethyl 3-chloro-6-methylimidazo[1,2-a]pyridine-2-carboxylate;toluene

C97H96Cl6F4N16O14S3 — CID 157277787

About tert-butyl N-(benzenesulfonyl)-N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)carbamate;tert-butyl N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)carbamate;3-chloro-6-methylimidazo[1,2-a]pyridine-2-carboxylic acid;N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)benzenesulfonamide;N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]benzenesulfonamide;ethane;ethyl 3-chloro-6-methylimidazo[1,2-a]pyridine-2-carboxylate;toluene

tert-butyl N-(benzenesulfonyl)-N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)carbamate;tert-butyl N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)carbamate;3-chloro-6-methylimidazo[1,2-a]pyridine-2-carboxylic acid;N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)benzenesulfonamide;N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]benzenesulfonamide;ethane;ethyl 3-chloro-6-methylimidazo[1,2-a]pyridine-2-carboxylate;toluene (PubChem CID 157277787) has the molecular formula C97H96Cl6F4N16O14S3 and a molecular weight of 2094.84 g/mol. Its IUPAC name is tert-butyl N-(benzenesulfonyl)-N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)carbamate;tert-butyl N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)carbamate;3-chloro-6-methylimidazo[1,2-a]pyridine-2-carboxylic acid;N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)benzenesulfonamide;N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]benzenesulfonamide;ethane;ethyl 3-chloro-6-methylimidazo[1,2-a]pyridine-2-carboxylate;toluene.

Molecular Properties

• Compound Name: tert-butyl N-(benzenesulfonyl)-N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)carbamate;tert-butyl N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)carbamate;3-chloro-6-methylimidazo[1,2-a]pyridine-2-carboxylic acid;N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)benzenesulfonamide;N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]benzenesulfonamide;ethane;ethyl 3-chloro-6-methylimidazo[1,2-a]pyridine-2-carboxylate;toluene
• PubChem CID: 157277787
• Molecular Formula: C97H96Cl6F4N16O14S3
• Molecular Weight: 2094.84 g/mol
• Exact Mass: 2090.45
• IUPAC Name: tert-butyl N-(benzenesulfonyl)-N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)carbamate;tert-butyl N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)carbamate;3-chloro-6-methylimidazo[1,2-a]pyridine-2-carboxylic acid;N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)benzenesulfonamide;N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]benzenesulfonamide;ethane;ethyl 3-chloro-6-methylimidazo[1,2-a]pyridine-2-carboxylate;toluene
• SMILES: CC.CCOC(=O)c1nc2ccc(C)cn2c1Cl.Cc1ccc2nc(C(=O)O)c(Cl)n2c1.Cc1ccc2nc(N(C(=O)OC(C)(C)C)S(=O)(=O)c3ccccc3)c(Cl)n2c1.Cc1ccc2nc(N(Cc3ccc(C(F)(F)F)c(F)c3)S(=O)(=O)c3ccccc3)c(Cl)n2c1.Cc1ccc2nc(NC(=O)OC(C)(C)C)c(Cl)n2c1.Cc1ccc2nc(NS(=O)(=O)c3ccccc3)c(Cl)n2c1.Cc1ccccc1
• InChI: InChI=1S/C22H16ClF4N3O2S.C19H20ClN3O4S.C14H12ClN3O2S.C13H16ClN3O2.C11H11ClN2O2.C9H7ClN2O2.C7H8.C2H6/c1-14-7-10-19-28-21(20(23)29(19)12-14)30(33(31,32)16-5-3-2-4-6-16)13-15-8-9-17(18(24)11-15)22(25,26)27;1-13-10-11-15-21-17(16(20)22(15)12-13)23(18(24)27-19(2,3)4)28(25,26)14-8-6-5-7-9-14;1-10-7-8-12-16-14(13(15)18(12)9-10)17-21(19,20)11-5-3-2-4-6-11;1-8-5-6-9-15-11(10(14)17(9)7-8)16-12(18)19-13(2,3)4;1-3-16-11(15)9-10(12)14-6-7(2)4-5-8(14)13-9;1-5-2-3-6-11-7(9(13)14)8(10)12(6)4-5;1-7-5-3-2-4-6-7;1-2/h2-12H,13H2,1H3;5-12H,1-4H3;2-9,17H,1H3;5-7H,1-4H3,(H,16,18);4-6H,3H2,1-2H3;2-4H,1H3,(H,13,14);2-6H,1H3;1-2H3
• InChIKey: AZHPKUPCUABQNJ-UHFFFAOYSA-N
• XLogP: 24.50
• TPSA: 352.96 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 25
• Rotatable Bonds: 15
• Heavy Atoms: 140
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2094.84
LogP ≤ 5	24.50
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	25

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-(benzenesulfonyl)-N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)carbamate;tert-butyl N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)carbamate;3-chloro-6-methylimidazo[1,2-a]pyridine-2-carboxylic acid;N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)benzenesulfonamide;N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]benzenesulfonamide;ethane;ethyl 3-chloro-6-methylimidazo[1,2-a]pyridine-2-carboxylate;toluene?

The IUPAC name of tert-butyl N-(benzenesulfonyl)-N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)carbamate;tert-butyl N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)carbamate;3-chloro-6-methylimidazo[1,2-a]pyridine-2-carboxylic acid;N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)benzenesulfonamide;N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]benzenesulfonamide;ethane;ethyl 3-chloro-6-methylimidazo[1,2-a]pyridine-2-carboxylate;toluene (CID 157277787) is tert-butyl N-(benzenesulfonyl)-N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)carbamate;tert-butyl N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)carbamate;3-chloro-6-methylimidazo[1,2-a]pyridine-2-carboxylic acid;N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)benzenesulfonamide;N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]benzenesulfonamide;ethane;ethyl 3-chloro-6-methylimidazo[1,2-a]pyridine-2-carboxylate;toluene.

What is the SMILES notation for tert-butyl N-(benzenesulfonyl)-N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)carbamate;tert-butyl N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)carbamate;3-chloro-6-methylimidazo[1,2-a]pyridine-2-carboxylic acid;N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)benzenesulfonamide;N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]benzenesulfonamide;ethane;ethyl 3-chloro-6-methylimidazo[1,2-a]pyridine-2-carboxylate;toluene?

The canonical SMILES for tert-butyl N-(benzenesulfonyl)-N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)carbamate;tert-butyl N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)carbamate;3-chloro-6-methylimidazo[1,2-a]pyridine-2-carboxylic acid;N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)benzenesulfonamide;N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]benzenesulfonamide;ethane;ethyl 3-chloro-6-methylimidazo[1,2-a]pyridine-2-carboxylate;toluene is CC.CCOC(=O)c1nc2ccc(C)cn2c1Cl.Cc1ccc2nc(C(=O)O)c(Cl)n2c1.Cc1ccc2nc(N(C(=O)OC(C)(C)C)S(=O)(=O)c3ccccc3)c(Cl)n2c1.Cc1ccc2nc(N(Cc3ccc(C(F)(F)F)c(F)c3)S(=O)(=O)c3ccccc3)c(Cl)n2c1.Cc1ccc2nc(NC(=O)OC(C)(C)C)c(Cl)n2c1.Cc1ccc2nc(NS(=O)(=O)c3ccccc3)c(Cl)n2c1.Cc1ccccc1.

What is the InChIKey of tert-butyl N-(benzenesulfonyl)-N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)carbamate;tert-butyl N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)carbamate;3-chloro-6-methylimidazo[1,2-a]pyridine-2-carboxylic acid;N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)benzenesulfonamide;N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]benzenesulfonamide;ethane;ethyl 3-chloro-6-methylimidazo[1,2-a]pyridine-2-carboxylate;toluene?

The InChIKey is AZHPKUPCUABQNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16ClF4N3O2S.C19H20ClN3O4S.C14H12ClN3O2S.C13H16ClN3O2.C11H11ClN2O2.C9H7ClN2O2.C7H8.C2H6/c1-14-7-10-19-28-21(20(23)29(19)12-14)30(33(31,32)16-5-3-2-4-6-16)13-15-8-9-17(18(24)11-15)22(25,26)27;1-13-10-11-15-21-17(16(20)22(15)12-13)23(18(24)27-19(2,3)4)28(25,26)14-8-6-5-7-9-14;1-10-7-8-12-16-14(13(15)18(12)9-10)17-21(19,20)11-5-3-2-4-6-11;1-8-5-6-9-15-11(10(14)17(9)7-8)16-12(18)19-13(2,3)4;1-3-16-11(15)9-10(12)14-6-7(2)4-5-8(14)13-9;1-5-2-3-6-11-7(9(13)14)8(10)12(6)4-5;1-7-5-3-2-4-6-7;1-2/h2-12H,13H2,1H3;5-12H,1-4H3;2-9,17H,1H3;5-7H,1-4H3,(H,16,18);4-6H,3H2,1-2H3;2-4H,1H3,(H,13,14);2-6H,1H3;1-2H3.

What are the key properties of tert-butyl N-(benzenesulfonyl)-N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)carbamate;tert-butyl N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)carbamate;3-chloro-6-methylimidazo[1,2-a]pyridine-2-carboxylic acid;N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)benzenesulfonamide;N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]benzenesulfonamide;ethane;ethyl 3-chloro-6-methylimidazo[1,2-a]pyridine-2-carboxylate;toluene?

tert-butyl N-(benzenesulfonyl)-N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)carbamate;tert-butyl N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)carbamate;3-chloro-6-methylimidazo[1,2-a]pyridine-2-carboxylic acid;N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)benzenesulfonamide;N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]benzenesulfonamide;ethane;ethyl 3-chloro-6-methylimidazo[1,2-a]pyridine-2-carboxylate;toluene has a molecular weight of 2094.84 g/mol, XLogP of 24.50, 15 rotatable bonds, 3 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for tert-butyl N-(benzenesulfonyl)-N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)carbamate;tert-butyl N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)carbamate;3-chloro-6-methylimidazo[1,2-a]pyridine-2-carboxylic acid;N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)benzenesulfonamide;N-(3-chloro-6-methylimidazo[1,2-a]pyridin-2-yl)-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]benzenesulfonamide;ethane;ethyl 3-chloro-6-methylimidazo[1,2-a]pyridine-2-carboxylate;toluene is sourced from PubChem (CID 157277787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).