tert-butyl 4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carboxylate;4-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-3-[[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methyl]-6-phenylimidazo[1,2-a]pyridine;4-[[2-(4-chlorophenyl)-6-(2-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-6-phenyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine

C154H150Cl6FN21O9S — CID 159093101

IUPACtert-butyl 4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carboxylate;4-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-3-[[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methyl]-6-phenylimidazo[1,2-a]pyridine;4-[[2-(4-chlorophenyl)-6-(2-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-6-phenyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine
SMILESCC(C)(C)OC(=O)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4)cn23)CC1.COc1ccc(-c2ccc3nc(-c4ccc(Cl)cc4)c(CN4CCOCC4)n3c2)cc1.COc1ccccc1-c1ccc2nc(-c3ccc(Cl)cc3)c(CN3CCOCC3)n2c1.Clc1ccc(-c2nc3ccc(-c4ccccc4)cn3c2CN2CCNCC2)cc1.Clc1ccc(-c2nc3ccc(C4CC4)cn3c2CN2CCOCC2)cc1.O=S(=O)(c1cccc(F)c1)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4)cn23)CC1
InChIInChI=1S/C30H26ClFN4O2S.C29H31ClN4O2.2C25H24ClN3O2.C24H23ClN4.C21H22ClN3O/c31-25-12-9-23(10-13-25)30-28(36-20-24(11-14-29(36)33-30)22-5-2-1-3-6-22)21-34-15-17-35(18-16-34)39(37,38)27-8-4-7-26(32)19-27;1-29(2,3)36-28(35)33-17-15-32(16-18-33)20-25-27(22-9-12-24(30)13-10-22)31-26-14-11-23(19-34(25)26)21-7-5-4-6-8-21;1-30-22-9-4-18(5-10-22)20-6-11-24-27-25(19-2-7-21(26)8-3-19)23(29(24)16-20)17-28-12-14-31-15-13-28;1-30-23-5-3-2-4-21(23)19-8-11-24-27-25(18-6-9-20(26)10-7-18)22(29(24)16-19)17-28-12-14-31-15-13-28;25-21-9-6-19(7-10-21)24-22(17-28-14-12-26-13-15-28)29-16-20(8-11-23(29)27-24)18-4-2-1-3-5-18;22-18-6-3-16(4-7-18)21-19(14-24-9-11-26-12-10-24)25-13-17(15-1-2-15)5-8-20(25)23-21/h1-14,19-20H,15-18,21H2;4-14,19H,15-18,20H2,1-3H3;2*2-11,16H,12-15,17H2,1H3;1-11,16,26H,12-15,17H2;3-8,13,15H,1-2,9-12,14H2
InChIKeyKCIAZYIMGWGSFG-UHFFFAOYSA-N
MW2702.81 g/mol
LogP31.76
Rot. Bonds28

About tert-butyl 4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carboxylate;4-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-3-[[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methyl]-6-phenylimidazo[1,2-a]pyridine;4-[[2-(4-chlorophenyl)-6-(2-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-6-phenyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine

tert-butyl 4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carboxylate;4-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-3-[[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methyl]-6-phenylimidazo[1,2-a]pyridine;4-[[2-(4-chlorophenyl)-6-(2-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-6-phenyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine (PubChem CID 159093101) has the molecular formula C154H150Cl6FN21O9S and a molecular weight of 2702.81 g/mol. Its IUPAC name is tert-butyl 4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carboxylate;4-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-3-[[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methyl]-6-phenylimidazo[1,2-a]pyridine;4-[[2-(4-chlorophenyl)-6-(2-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-6-phenyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Nametert-butyl 4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carboxylate;4-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-3-[[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methyl]-6-phenylimidazo[1,2-a]pyridine;4-[[2-(4-chlorophenyl)-6-(2-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-6-phenyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine
PubChem CID159093101
Molecular FormulaC154H150Cl6FN21O9S
Molecular Weight2702.81 g/mol
Exact Mass2697.98
IUPAC Nametert-butyl 4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carboxylate;4-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-3-[[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methyl]-6-phenylimidazo[1,2-a]pyridine;4-[[2-(4-chlorophenyl)-6-(2-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-6-phenyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine
SMILESCC(C)(C)OC(=O)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4)cn23)CC1.COc1ccc(-c2ccc3nc(-c4ccc(Cl)cc4)c(CN4CCOCC4)n3c2)cc1.COc1ccccc1-c1ccc2nc(-c3ccc(Cl)cc3)c(CN3CCOCC3)n2c1.Clc1ccc(-c2nc3ccc(-c4ccccc4)cn3c2CN2CCNCC2)cc1.Clc1ccc(-c2nc3ccc(C4CC4)cn3c2CN2CCOCC2)cc1.O=S(=O)(c1cccc(F)c1)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4)cn23)CC1
InChIInChI=1S/C30H26ClFN4O2S.C29H31ClN4O2.2C25H24ClN3O2.C24H23ClN4.C21H22ClN3O/c31-25-12-9-23(10-13-25)30-28(36-20-24(11-14-29(36)33-30)22-5-2-1-3-6-22)21-34-15-17-35(18-16-34)39(37,38)27-8-4-7-26(32)19-27;1-29(2,3)36-28(35)33-17-15-32(16-18-33)20-25-27(22-9-12-24(30)13-10-22)31-26-14-11-23(19-34(25)26)21-7-5-4-6-8-21;1-30-22-9-4-18(5-10-22)20-6-11-24-27-25(19-2-7-21(26)8-3-19)23(29(24)16-20)17-28-12-14-31-15-13-28;1-30-23-5-3-2-4-21(23)19-8-11-24-27-25(18-6-9-20(26)10-7-18)22(29(24)16-19)17-28-12-14-31-15-13-28;25-21-9-6-19(7-10-21)24-22(17-28-14-12-26-13-15-28)29-16-20(8-11-23(29)27-24)18-4-2-1-3-5-18;22-18-6-3-16(4-7-18)21-19(14-24-9-11-26-12-10-24)25-13-17(15-1-2-15)5-8-20(25)23-21/h1-14,19-20H,15-18,21H2;4-14,19H,15-18,20H2,1-3H3;2*2-11,16H,12-15,17H2,1H3;1-11,16,26H,12-15,17H2;3-8,13,15H,1-2,9-12,14H2
InChIKeyKCIAZYIMGWGSFG-UHFFFAOYSA-N
XLogP31.76
TPSA248.34 Ų
H-Bond Donors1
H-Bond Acceptors28
Rotatable Bonds28
Heavy Atoms192
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002702.81
LogP ≤ 531.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1028

Analyze tert-butyl 4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carboxylate;4-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-3-[[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methyl]-6-phenylimidazo[1,2-a]pyridine;4-[[2-(4-chlorophenyl)-6-(2-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-6-phenyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of tert-butyl 4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carboxylate;4-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-3-[[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methyl]-6-phenylimidazo[1,2-a]pyridine;4-[[2-(4-chlorophenyl)-6-(2-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-6-phenyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine?
The IUPAC name of tert-butyl 4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carboxylate;4-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-3-[[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methyl]-6-phenylimidazo[1,2-a]pyridine;4-[[2-(4-chlorophenyl)-6-(2-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-6-phenyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine (CID 159093101) is tert-butyl 4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carboxylate;4-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-3-[[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methyl]-6-phenylimidazo[1,2-a]pyridine;4-[[2-(4-chlorophenyl)-6-(2-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-6-phenyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine.
What is the SMILES notation for tert-butyl 4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carboxylate;4-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-3-[[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methyl]-6-phenylimidazo[1,2-a]pyridine;4-[[2-(4-chlorophenyl)-6-(2-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-6-phenyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine?
The canonical SMILES for tert-butyl 4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carboxylate;4-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-3-[[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methyl]-6-phenylimidazo[1,2-a]pyridine;4-[[2-(4-chlorophenyl)-6-(2-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-6-phenyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine is CC(C)(C)OC(=O)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4)cn23)CC1.COc1ccc(-c2ccc3nc(-c4ccc(Cl)cc4)c(CN4CCOCC4)n3c2)cc1.COc1ccccc1-c1ccc2nc(-c3ccc(Cl)cc3)c(CN3CCOCC3)n2c1.Clc1ccc(-c2nc3ccc(-c4ccccc4)cn3c2CN2CCNCC2)cc1.Clc1ccc(-c2nc3ccc(C4CC4)cn3c2CN2CCOCC2)cc1.O=S(=O)(c1cccc(F)c1)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4)cn23)CC1.
What is the InChIKey of tert-butyl 4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carboxylate;4-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-3-[[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methyl]-6-phenylimidazo[1,2-a]pyridine;4-[[2-(4-chlorophenyl)-6-(2-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-6-phenyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine?
The InChIKey is KCIAZYIMGWGSFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H26ClFN4O2S.C29H31ClN4O2.2C25H24ClN3O2.C24H23ClN4.C21H22ClN3O/c31-25-12-9-23(10-13-25)30-28(36-20-24(11-14-29(36)33-30)22-5-2-1-3-6-22)21-34-15-17-35(18-16-34)39(37,38)27-8-4-7-26(32)19-27;1-29(2,3)36-28(35)33-17-15-32(16-18-33)20-25-27(22-9-12-24(30)13-10-22)31-26-14-11-23(19-34(25)26)21-7-5-4-6-8-21;1-30-22-9-4-18(5-10-22)20-6-11-24-27-25(19-2-7-21(26)8-3-19)23(29(24)16-20)17-28-12-14-31-15-13-28;1-30-23-5-3-2-4-21(23)19-8-11-24-27-25(18-6-9-20(26)10-7-18)22(29(24)16-19)17-28-12-14-31-15-13-28;25-21-9-6-19(7-10-21)24-22(17-28-14-12-26-13-15-28)29-16-20(8-11-23(29)27-24)18-4-2-1-3-5-18;22-18-6-3-16(4-7-18)21-19(14-24-9-11-26-12-10-24)25-13-17(15-1-2-15)5-8-20(25)23-21/h1-14,19-20H,15-18,21H2;4-14,19H,15-18,20H2,1-3H3;2*2-11,16H,12-15,17H2,1H3;1-11,16,26H,12-15,17H2;3-8,13,15H,1-2,9-12,14H2.
What are the key properties of tert-butyl 4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carboxylate;4-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-3-[[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methyl]-6-phenylimidazo[1,2-a]pyridine;4-[[2-(4-chlorophenyl)-6-(2-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-6-phenyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine?
tert-butyl 4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carboxylate;4-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-3-[[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methyl]-6-phenylimidazo[1,2-a]pyridine;4-[[2-(4-chlorophenyl)-6-(2-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-6-phenyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine has a molecular weight of 2702.81 g/mol, XLogP of 31.76, 28 rotatable bonds, 1 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazine-1-carboxylate;4-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-3-[[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methyl]-6-phenylimidazo[1,2-a]pyridine;4-[[2-(4-chlorophenyl)-6-(2-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;4-[[2-(4-chlorophenyl)-6-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-(4-chlorophenyl)-6-phenyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 159093101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).