1-[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxetan-3-yl)methanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-4-ylmethanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-(4-methylpiperazin-1-yl)methanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone

C122H111Cl5N26O11 — CID 160661218

IUPAC1-[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxetan-3-yl)methanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-4-ylmethanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-(4-methylpiperazin-1-yl)methanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone
SMILESCN1CCN(C(=O)c2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4)cn23)CC1.COCC(=O)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ncon4)cn23)CC1.O=C(C1COC1)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ncon4)cn23)CC1.O=C(c1c(-c2ccc(Cl)cc2)nc2ccc(-c3ccccc3)cn12)N1CCOCC1.O=C(c1ccncc1)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ncon4)cn23)CC1
InChIInChI=1S/C26H22ClN7O2.C25H23ClN4O.C24H23ClN6O3.C24H20ClN3O2.C23H23ClN6O3/c27-21-4-1-18(2-5-21)24-22(34-15-20(3-6-23(34)30-24)25-29-17-36-31-25)16-32-11-13-33(14-12-32)26(35)19-7-9-28-10-8-19;1-28-13-15-29(16-14-28)25(31)24-23(19-7-10-21(26)11-8-19)27-22-12-9-20(17-30(22)24)18-5-3-2-4-6-18;25-19-4-1-16(2-5-19)22-20(12-29-7-9-30(10-8-29)24(32)18-13-33-14-18)31-11-17(3-6-21(31)27-22)23-26-15-34-28-23;25-20-9-6-18(7-10-20)22-23(24(29)27-12-14-30-15-13-27)28-16-19(8-11-21(28)26-22)17-4-2-1-3-5-17;1-32-14-21(31)29-10-8-28(9-11-29)13-19-22(16-2-5-18(24)6-3-16)26-20-7-4-17(12-30(19)20)23-25-15-33-27-23/h1-10,15,17H,11-14,16H2;2-12,17H,13-16H2,1H3;1-6,11,15,18H,7-10,12-14H2;1-11,16H,12-15H2;2-7,12,15H,8-11,13-14H2,1H3
InChIKeyRLRSYFOODGHPMM-UHFFFAOYSA-N
MW2294.67 g/mol
LogP19.55
Rot. Bonds22

About 1-[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxetan-3-yl)methanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-4-ylmethanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-(4-methylpiperazin-1-yl)methanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone

1-[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxetan-3-yl)methanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-4-ylmethanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-(4-methylpiperazin-1-yl)methanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone (PubChem CID 160661218) has the molecular formula C122H111Cl5N26O11 and a molecular weight of 2294.67 g/mol. Its IUPAC name is 1-[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxetan-3-yl)methanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-4-ylmethanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-(4-methylpiperazin-1-yl)methanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name1-[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxetan-3-yl)methanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-4-ylmethanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-(4-methylpiperazin-1-yl)methanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone
PubChem CID160661218
Molecular FormulaC122H111Cl5N26O11
Molecular Weight2294.67 g/mol
Exact Mass2290.74
IUPAC Name1-[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxetan-3-yl)methanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-4-ylmethanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-(4-methylpiperazin-1-yl)methanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone
SMILESCN1CCN(C(=O)c2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4)cn23)CC1.COCC(=O)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ncon4)cn23)CC1.O=C(C1COC1)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ncon4)cn23)CC1.O=C(c1c(-c2ccc(Cl)cc2)nc2ccc(-c3ccccc3)cn12)N1CCOCC1.O=C(c1ccncc1)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ncon4)cn23)CC1
InChIInChI=1S/C26H22ClN7O2.C25H23ClN4O.C24H23ClN6O3.C24H20ClN3O2.C23H23ClN6O3/c27-21-4-1-18(2-5-21)24-22(34-15-20(3-6-23(34)30-24)25-29-17-36-31-25)16-32-11-13-33(14-12-32)26(35)19-7-9-28-10-8-19;1-28-13-15-29(16-14-28)25(31)24-23(19-7-10-21(26)11-8-19)27-22-12-9-20(17-30(22)24)18-5-3-2-4-6-18;25-19-4-1-16(2-5-19)22-20(12-29-7-9-30(10-8-29)24(32)18-13-33-14-18)31-11-17(3-6-21(31)27-22)23-26-15-34-28-23;25-20-9-6-18(7-10-20)22-23(24(29)27-12-14-30-15-13-27)28-16-19(8-11-21(28)26-22)17-4-2-1-3-5-17;1-32-14-21(31)29-10-8-28(9-11-29)13-19-22(16-2-5-18(24)6-3-16)26-20-7-4-17(12-30(19)20)23-25-15-33-27-23/h1-10,15,17H,11-14,16H2;2-12,17H,13-16H2,1H3;1-6,11,15,18H,7-10,12-14H2;1-11,16H,12-15H2;2-7,12,15H,8-11,13-14H2,1H3
InChIKeyRLRSYFOODGHPMM-UHFFFAOYSA-N
XLogP19.55
TPSA358.35 Ų
H-Bond Donors
H-Bond Acceptors32
Rotatable Bonds22
Heavy Atoms164
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002294.67
LogP ≤ 519.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1032

Analyze 1-[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxetan-3-yl)methanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-4-ylmethanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-(4-methylpiperazin-1-yl)methanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxetan-3-yl)methanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-4-ylmethanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-(4-methylpiperazin-1-yl)methanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone?
The IUPAC name of 1-[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxetan-3-yl)methanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-4-ylmethanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-(4-methylpiperazin-1-yl)methanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone (CID 160661218) is 1-[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxetan-3-yl)methanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-4-ylmethanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-(4-methylpiperazin-1-yl)methanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for 1-[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxetan-3-yl)methanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-4-ylmethanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-(4-methylpiperazin-1-yl)methanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone?
The canonical SMILES for 1-[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxetan-3-yl)methanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-4-ylmethanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-(4-methylpiperazin-1-yl)methanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone is CN1CCN(C(=O)c2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4)cn23)CC1.COCC(=O)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ncon4)cn23)CC1.O=C(C1COC1)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ncon4)cn23)CC1.O=C(c1c(-c2ccc(Cl)cc2)nc2ccc(-c3ccccc3)cn12)N1CCOCC1.O=C(c1ccncc1)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ncon4)cn23)CC1.
What is the InChIKey of 1-[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxetan-3-yl)methanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-4-ylmethanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-(4-methylpiperazin-1-yl)methanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone?
The InChIKey is RLRSYFOODGHPMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22ClN7O2.C25H23ClN4O.C24H23ClN6O3.C24H20ClN3O2.C23H23ClN6O3/c27-21-4-1-18(2-5-21)24-22(34-15-20(3-6-23(34)30-24)25-29-17-36-31-25)16-32-11-13-33(14-12-32)26(35)19-7-9-28-10-8-19;1-28-13-15-29(16-14-28)25(31)24-23(19-7-10-21(26)11-8-19)27-22-12-9-20(17-30(22)24)18-5-3-2-4-6-18;25-19-4-1-16(2-5-19)22-20(12-29-7-9-30(10-8-29)24(32)18-13-33-14-18)31-11-17(3-6-21(31)27-22)23-26-15-34-28-23;25-20-9-6-18(7-10-20)22-23(24(29)27-12-14-30-15-13-27)28-16-19(8-11-21(28)26-22)17-4-2-1-3-5-17;1-32-14-21(31)29-10-8-28(9-11-29)13-19-22(16-2-5-18(24)6-3-16)26-20-7-4-17(12-30(19)20)23-25-15-33-27-23/h1-10,15,17H,11-14,16H2;2-12,17H,13-16H2,1H3;1-6,11,15,18H,7-10,12-14H2;1-11,16H,12-15H2;2-7,12,15H,8-11,13-14H2,1H3.
What are the key properties of 1-[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxetan-3-yl)methanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-4-ylmethanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-(4-methylpiperazin-1-yl)methanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone?
1-[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxetan-3-yl)methanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-4-ylmethanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-(4-methylpiperazin-1-yl)methanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone has a molecular weight of 2294.67 g/mol, XLogP of 19.55, 22 rotatable bonds, 0 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxetan-3-yl)methanone;[4-[[2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-4-ylmethanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-(4-methylpiperazin-1-yl)methanone;[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 160661218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).