6-bromo-3-iodo-2-methylimidazo[1,2-a]pyridine;6-bromo-2-methylimidazo[1,2-a]pyridine;N-[5-(6-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)-2-chloro-3-pyridinyl]-4-fluorobenzenesulfonamide

C35H26Br3ClFIN8O2S — CID 158363610

IUPAC6-bromo-3-iodo-2-methylimidazo[1,2-a]pyridine;6-bromo-2-methylimidazo[1,2-a]pyridine;N-[5-(6-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)-2-chloro-3-pyridinyl]-4-fluorobenzenesulfonamide
SMILESCc1cn2cc(Br)ccc2n1.Cc1nc2ccc(Br)cn2c1-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1.Cc1nc2ccc(Br)cn2c1I
InChIInChI=1S/C19H13BrClFN4O2S.C8H6BrIN2.C8H7BrN2/c1-11-18(26-10-13(20)2-7-17(26)24-11)12-8-16(19(21)23-9-12)25-29(27,28)15-5-3-14(22)4-6-15;1-5-8(10)12-4-6(9)2-3-7(12)11-5;1-6-4-11-5-7(9)2-3-8(11)10-6/h2-10,25H,1H3;2-4H,1H3;2-5H,1H3
InChIKeyGTTLLEXXWVJQFB-UHFFFAOYSA-N
MW1043.78 g/mol
LogP10.48
Rot. Bonds4

About 6-bromo-3-iodo-2-methylimidazo[1,2-a]pyridine;6-bromo-2-methylimidazo[1,2-a]pyridine;N-[5-(6-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)-2-chloro-3-pyridinyl]-4-fluorobenzenesulfonamide

6-bromo-3-iodo-2-methylimidazo[1,2-a]pyridine;6-bromo-2-methylimidazo[1,2-a]pyridine;N-[5-(6-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)-2-chloro-3-pyridinyl]-4-fluorobenzenesulfonamide (PubChem CID 158363610) has the molecular formula C35H26Br3ClFIN8O2S and a molecular weight of 1043.78 g/mol. Its IUPAC name is 6-bromo-3-iodo-2-methylimidazo[1,2-a]pyridine;6-bromo-2-methylimidazo[1,2-a]pyridine;N-[5-(6-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)-2-chloro-3-pyridinyl]-4-fluorobenzenesulfonamide.

Molecular Properties

Compound Name6-bromo-3-iodo-2-methylimidazo[1,2-a]pyridine;6-bromo-2-methylimidazo[1,2-a]pyridine;N-[5-(6-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)-2-chloro-3-pyridinyl]-4-fluorobenzenesulfonamide
PubChem CID158363610
Molecular FormulaC35H26Br3ClFIN8O2S
Molecular Weight1043.78 g/mol
Exact Mass1039.82
IUPAC Name6-bromo-3-iodo-2-methylimidazo[1,2-a]pyridine;6-bromo-2-methylimidazo[1,2-a]pyridine;N-[5-(6-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)-2-chloro-3-pyridinyl]-4-fluorobenzenesulfonamide
SMILESCc1cn2cc(Br)ccc2n1.Cc1nc2ccc(Br)cn2c1-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1.Cc1nc2ccc(Br)cn2c1I
InChIInChI=1S/C19H13BrClFN4O2S.C8H6BrIN2.C8H7BrN2/c1-11-18(26-10-13(20)2-7-17(26)24-11)12-8-16(19(21)23-9-12)25-29(27,28)15-5-3-14(22)4-6-15;1-5-8(10)12-4-6(9)2-3-7(12)11-5;1-6-4-11-5-7(9)2-3-8(11)10-6/h2-10,25H,1H3;2-4H,1H3;2-5H,1H3
InChIKeyGTTLLEXXWVJQFB-UHFFFAOYSA-N
XLogP10.48
TPSA110.96 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds4
Heavy Atoms52
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001043.78
LogP ≤ 510.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

Analyze 6-bromo-3-iodo-2-methylimidazo[1,2-a]pyridine;6-bromo-2-methylimidazo[1,2-a]pyridine;N-[5-(6-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)-2-chloro-3-pyridinyl]-4-fluorobenzenesulfonamide with MolForge

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Related Compounds

N-[2-chloro-5-(6-pyridin-3-ylimidazo[1,2-a]pyridin-3-yl)-3-pyridinyl]-4-fluorobenzenesulfonamide
CID 46898104
N-(2-Chloro-5-(2-methylimidazo[1,2-a]pyridin-3-yl)-3-pyridinyl)-4-fluorobenzenesulfonamide
CID 46913214
N-(2-chloro-5-imidazo[1,2-a]pyridin-3-yl-3-pyridinyl)-4-fluorobenzenesulfonamide
CID 46913311
N-[2-chloro-5-(7-methylimidazo[1,2-a]pyridin-3-yl)-3-pyridinyl]-4-fluorobenzenesulfonamide
CID 46913312
N-[5-(6-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)-2-chloro-3-pyridinyl]-4-fluorobenzenesulfonamide
CID 46913313
N-[5-(6-bromoimidazo[1,2-a]pyridin-3-yl)-2-chloro-3-pyridinyl]-4-fluorobenzenesulfonamide
CID 46913314
N-[2-chloro-5-(6-pyridin-4-ylimidazo[1,2-a]pyridin-3-yl)-3-pyridinyl]-4-fluorobenzenesulfonamide
CID 46913315
N-[[4-[2-(2-amino-3-pyridinyl)-6-bromoimidazo[4,5-b]pyridin-3-yl]phenyl]methyl]-3-chloro-4-fluorobenzenesulfonamide
CID 58345260
N-[2-chloro-5-(2-methylimidazo[1,2-a]pyridin-3-yl)-3-pyridinyl]-4-fluorobenzenesulfinamide
CID 144057731
N-[[4-[2-(2-amino-3-pyridinyl)-6-bromoimidazo[4,5-b]pyridin-3-yl]phenyl]methyl]-3-chlorobenzenesulfonamide
CID 58344977
N-[[4-[2-(2-amino-3-pyridinyl)-6-bromoimidazo[4,5-b]pyridin-3-yl]phenyl]methyl]-2-chlorobenzenesulfonamide
CID 58345204
8-(Benzenesulfonyl)-12-bromo-3-chloro-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaen-4-amine
CID 68331437

Frequently Asked Questions

What is the IUPAC name of 6-bromo-3-iodo-2-methylimidazo[1,2-a]pyridine;6-bromo-2-methylimidazo[1,2-a]pyridine;N-[5-(6-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)-2-chloro-3-pyridinyl]-4-fluorobenzenesulfonamide?
The IUPAC name of 6-bromo-3-iodo-2-methylimidazo[1,2-a]pyridine;6-bromo-2-methylimidazo[1,2-a]pyridine;N-[5-(6-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)-2-chloro-3-pyridinyl]-4-fluorobenzenesulfonamide (CID 158363610) is 6-bromo-3-iodo-2-methylimidazo[1,2-a]pyridine;6-bromo-2-methylimidazo[1,2-a]pyridine;N-[5-(6-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)-2-chloro-3-pyridinyl]-4-fluorobenzenesulfonamide.
What is the SMILES notation for 6-bromo-3-iodo-2-methylimidazo[1,2-a]pyridine;6-bromo-2-methylimidazo[1,2-a]pyridine;N-[5-(6-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)-2-chloro-3-pyridinyl]-4-fluorobenzenesulfonamide?
The canonical SMILES for 6-bromo-3-iodo-2-methylimidazo[1,2-a]pyridine;6-bromo-2-methylimidazo[1,2-a]pyridine;N-[5-(6-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)-2-chloro-3-pyridinyl]-4-fluorobenzenesulfonamide is Cc1cn2cc(Br)ccc2n1.Cc1nc2ccc(Br)cn2c1-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1.Cc1nc2ccc(Br)cn2c1I.
What is the InChIKey of 6-bromo-3-iodo-2-methylimidazo[1,2-a]pyridine;6-bromo-2-methylimidazo[1,2-a]pyridine;N-[5-(6-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)-2-chloro-3-pyridinyl]-4-fluorobenzenesulfonamide?
The InChIKey is GTTLLEXXWVJQFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13BrClFN4O2S.C8H6BrIN2.C8H7BrN2/c1-11-18(26-10-13(20)2-7-17(26)24-11)12-8-16(19(21)23-9-12)25-29(27,28)15-5-3-14(22)4-6-15;1-5-8(10)12-4-6(9)2-3-7(12)11-5;1-6-4-11-5-7(9)2-3-8(11)10-6/h2-10,25H,1H3;2-4H,1H3;2-5H,1H3.
What are the key properties of 6-bromo-3-iodo-2-methylimidazo[1,2-a]pyridine;6-bromo-2-methylimidazo[1,2-a]pyridine;N-[5-(6-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)-2-chloro-3-pyridinyl]-4-fluorobenzenesulfonamide?
6-bromo-3-iodo-2-methylimidazo[1,2-a]pyridine;6-bromo-2-methylimidazo[1,2-a]pyridine;N-[5-(6-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)-2-chloro-3-pyridinyl]-4-fluorobenzenesulfonamide has a molecular weight of 1043.78 g/mol, XLogP of 10.48, 4 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-3-iodo-2-methylimidazo[1,2-a]pyridine;6-bromo-2-methylimidazo[1,2-a]pyridine;N-[5-(6-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)-2-chloro-3-pyridinyl]-4-fluorobenzenesulfonamide is sourced from PubChem (CID 158363610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).