[4-[[6-(2-chlorophenyl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-cyclobutylmethanone;2-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methylamino]-N,N-dimethylacetamide;7-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]-3-methyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxan-4-yl)methanone

C109H105Cl5N18O4 — CID 158623127

About [4-[[6-(2-chlorophenyl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-cyclobutylmethanone;2-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methylamino]-N,N-dimethylacetamide;7-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]-3-methyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxan-4-yl)methanone

[4-[[6-(2-chlorophenyl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-cyclobutylmethanone;2-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methylamino]-N,N-dimethylacetamide;7-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]-3-methyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxan-4-yl)methanone (PubChem CID 158623127) has the molecular formula C109H105Cl5N18O4 and a molecular weight of 1908.43 g/mol. Its IUPAC name is [4-[[6-(2-chlorophenyl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-cyclobutylmethanone;2-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methylamino]-N,N-dimethylacetamide;7-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]-3-methyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxan-4-yl)methanone.

Molecular Properties

• Compound Name: [4-[[6-(2-chlorophenyl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-cyclobutylmethanone;2-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methylamino]-N,N-dimethylacetamide;7-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]-3-methyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxan-4-yl)methanone
• PubChem CID: 158623127
• Molecular Formula: C109H105Cl5N18O4
• Molecular Weight: 1908.43 g/mol
• Exact Mass: 1904.70
• IUPAC Name: [4-[[6-(2-chlorophenyl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-cyclobutylmethanone;2-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methylamino]-N,N-dimethylacetamide;7-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]-3-methyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxan-4-yl)methanone
• SMILES: CN(C)C(=O)CNCc1c(-c2ccc(Cl)cc2)nc2ccc(-c3ccccc3)cn12.Cc1nnc2n1CCN(Cc1c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4)cn13)C2.O=C(C1CCC1)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4Cl)cn23)CC1.O=C(C1CCOCC1)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4)cn23)CC1
• InChI: InChI=1S/C30H31ClN4O2.C29H28Cl2N4O.C26H23ClN6.C24H23ClN4O/c31-26-9-6-23(7-10-26)29-27(35-20-25(8-11-28(35)32-29)22-4-2-1-3-5-22)21-33-14-16-34(17-15-33)30(36)24-12-18-37-19-13-24;30-23-11-8-20(9-12-23)28-26(19-33-14-16-34(17-15-33)29(36)21-4-3-5-21)35-18-22(10-13-27(35)32-28)24-6-1-2-7-25(24)31;1-18-29-30-25-17-31(13-14-32(18)25)16-23-26(20-7-10-22(27)11-8-20)28-24-12-9-21(15-33(23)24)19-5-3-2-4-6-19;1-28(2)23(30)15-26-14-21-24(18-8-11-20(25)12-9-18)27-22-13-10-19(16-29(21)22)17-6-4-3-5-7-17/h1-11,20,24H,12-19,21H2;1-2,6-13,18,21H,3-5,14-17,19H2;2-12,15H,13-14,16-17H2,1H3;3-13,16,26H,14-15H2,1-2H3
• InChIKey: HYGDDIXRZHPHMH-UHFFFAOYSA-N
• XLogP: 21.55
• TPSA: 191.82 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 19
• Rotatable Bonds: 20
• Heavy Atoms: 136
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1908.43
LogP ≤ 5	21.55
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	19

Frequently Asked Questions

What is the IUPAC name of [4-[[6-(2-chlorophenyl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-cyclobutylmethanone;2-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methylamino]-N,N-dimethylacetamide;7-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]-3-methyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxan-4-yl)methanone?

The IUPAC name of [4-[[6-(2-chlorophenyl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-cyclobutylmethanone;2-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methylamino]-N,N-dimethylacetamide;7-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]-3-methyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxan-4-yl)methanone (CID 158623127) is [4-[[6-(2-chlorophenyl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-cyclobutylmethanone;2-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methylamino]-N,N-dimethylacetamide;7-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]-3-methyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxan-4-yl)methanone.

What is the SMILES notation for [4-[[6-(2-chlorophenyl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-cyclobutylmethanone;2-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methylamino]-N,N-dimethylacetamide;7-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]-3-methyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxan-4-yl)methanone?

The canonical SMILES for [4-[[6-(2-chlorophenyl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-cyclobutylmethanone;2-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methylamino]-N,N-dimethylacetamide;7-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]-3-methyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxan-4-yl)methanone is CN(C)C(=O)CNCc1c(-c2ccc(Cl)cc2)nc2ccc(-c3ccccc3)cn12.Cc1nnc2n1CCN(Cc1c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4)cn13)C2.O=C(C1CCC1)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4Cl)cn23)CC1.O=C(C1CCOCC1)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4)cn23)CC1.

What is the InChIKey of [4-[[6-(2-chlorophenyl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-cyclobutylmethanone;2-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methylamino]-N,N-dimethylacetamide;7-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]-3-methyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxan-4-yl)methanone?

The InChIKey is HYGDDIXRZHPHMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H31ClN4O2.C29H28Cl2N4O.C26H23ClN6.C24H23ClN4O/c31-26-9-6-23(7-10-26)29-27(35-20-25(8-11-28(35)32-29)22-4-2-1-3-5-22)21-33-14-16-34(17-15-33)30(36)24-12-18-37-19-13-24;30-23-11-8-20(9-12-23)28-26(19-33-14-16-34(17-15-33)29(36)21-4-3-5-21)35-18-22(10-13-27(35)32-28)24-6-1-2-7-25(24)31;1-18-29-30-25-17-31(13-14-32(18)25)16-23-26(20-7-10-22(27)11-8-20)28-24-12-9-21(15-33(23)24)19-5-3-2-4-6-19;1-28(2)23(30)15-26-14-21-24(18-8-11-20(25)12-9-18)27-22-13-10-19(16-29(21)22)17-6-4-3-5-7-17/h1-11,20,24H,12-19,21H2;1-2,6-13,18,21H,3-5,14-17,19H2;2-12,15H,13-14,16-17H2,1H3;3-13,16,26H,14-15H2,1-2H3.

What are the key properties of [4-[[6-(2-chlorophenyl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-cyclobutylmethanone;2-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methylamino]-N,N-dimethylacetamide;7-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]-3-methyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxan-4-yl)methanone?

[4-[[6-(2-chlorophenyl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-cyclobutylmethanone;2-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methylamino]-N,N-dimethylacetamide;7-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]-3-methyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxan-4-yl)methanone has a molecular weight of 1908.43 g/mol, XLogP of 21.55, 20 rotatable bonds, 1 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for [4-[[6-(2-chlorophenyl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-cyclobutylmethanone;2-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methylamino]-N,N-dimethylacetamide;7-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]-3-methyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxan-4-yl)methanone is sourced from PubChem (CID 158623127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).