2-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyrazin-3-yl]methyl]-1,3,4,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-6-one;4-[[2-(4-chlorophenyl)-6-methylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;1-[4-[[2-(4-chlorophenyl)-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;1-[4-[[2-(4-chlorophenyl)-6-pyrrolidin-1-ylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;N-[2-(2,4-dichlorophenyl)-3-[[4-(2-hydroxy-2-methylpropanoyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]-N-methylmethanesulfonamide

C113H128Cl6N22O14S4 — CID 159077869

About 2-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyrazin-3-yl]methyl]-1,3,4,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-6-one;4-[[2-(4-chlorophenyl)-6-methylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;1-[4-[[2-(4-chlorophenyl)-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;1-[4-[[2-(4-chlorophenyl)-6-pyrrolidin-1-ylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;N-[2-(2,4-dichlorophenyl)-3-[[4-(2-hydroxy-2-methylpropanoyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]-N-methylmethanesulfonamide

2-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyrazin-3-yl]methyl]-1,3,4,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-6-one;4-[[2-(4-chlorophenyl)-6-methylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;1-[4-[[2-(4-chlorophenyl)-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;1-[4-[[2-(4-chlorophenyl)-6-pyrrolidin-1-ylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;N-[2-(2,4-dichlorophenyl)-3-[[4-(2-hydroxy-2-methylpropanoyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]-N-methylmethanesulfonamide (PubChem CID 159077869) has the molecular formula C113H128Cl6N22O14S4 and a molecular weight of 2359.39 g/mol. Its IUPAC name is 2-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyrazin-3-yl]methyl]-1,3,4,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-6-one;4-[[2-(4-chlorophenyl)-6-methylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;1-[4-[[2-(4-chlorophenyl)-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;1-[4-[[2-(4-chlorophenyl)-6-pyrrolidin-1-ylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;N-[2-(2,4-dichlorophenyl)-3-[[4-(2-hydroxy-2-methylpropanoyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]-N-methylmethanesulfonamide.

Molecular Properties

• Compound Name: 2-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyrazin-3-yl]methyl]-1,3,4,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-6-one;4-[[2-(4-chlorophenyl)-6-methylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;1-[4-[[2-(4-chlorophenyl)-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;1-[4-[[2-(4-chlorophenyl)-6-pyrrolidin-1-ylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;N-[2-(2,4-dichlorophenyl)-3-[[4-(2-hydroxy-2-methylpropanoyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]-N-methylmethanesulfonamide
• PubChem CID: 159077869
• Molecular Formula: C113H128Cl6N22O14S4
• Molecular Weight: 2359.39 g/mol
• Exact Mass: 2354.70
• IUPAC Name: 2-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyrazin-3-yl]methyl]-1,3,4,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-6-one;4-[[2-(4-chlorophenyl)-6-methylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;1-[4-[[2-(4-chlorophenyl)-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;1-[4-[[2-(4-chlorophenyl)-6-pyrrolidin-1-ylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;N-[2-(2,4-dichlorophenyl)-3-[[4-(2-hydroxy-2-methylpropanoyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]-N-methylmethanesulfonamide
• SMILES: CC(=O)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(S(=O)(=O)C(C)C)cn23)CC1.CC(=O)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(S(=O)(=O)N4CCCC4)cn23)CC1.CN(c1ccc2nc(-c3ccc(Cl)cc3Cl)c(CN3CCN(C(=O)C(C)(C)O)CC3)n2c1)S(C)(=O)=O.CS(=O)(=O)c1ccc2nc(-c3ccc(Cl)cc3)c(CN3CCOCC3)n2c1.O=C1CCC2CN(Cc3c(-c4ccc(Cl)cc4)nc4cnc(C5CC5)cn34)CCN12
• InChI: InChI=1S/C24H29Cl2N5O4S.C24H28ClN5O3S.C23H24ClN5O.C23H27ClN4O3S.C19H20ClN3O3S/c1-24(2,33)23(32)30-11-9-29(10-12-30)15-20-22(18-7-5-16(25)13-19(18)26)27-21-8-6-17(14-31(20)21)28(3)36(4,34)35;1-18(31)28-14-12-27(13-15-28)17-22-24(19-4-6-20(25)7-5-19)26-23-9-8-21(16-30(22)23)34(32,33)29-10-2-3-11-29;24-17-5-3-16(4-6-17)23-20(14-27-9-10-28-18(12-27)7-8-22(28)30)29-13-19(15-1-2-15)25-11-21(29)26-23;1-16(2)32(30,31)20-8-9-22-25-23(18-4-6-19(24)7-5-18)21(28(22)14-20)15-26-10-12-27(13-11-26)17(3)29;1-27(24,25)16-6-7-18-21-19(14-2-4-15(20)5-3-14)17(23(18)12-16)13-22-8-10-26-11-9-22/h5-8,13-14,33H,9-12,15H2,1-4H3;4-9,16H,2-3,10-15,17H2,1H3;3-6,11,13,15,18H,1-2,7-10,12,14H2;4-9,14,16H,10-13,15H2,1-3H3;2-7,12H,8-11,13H2,1H3
• InChIKey: KALZEVZNEYWTJJ-UHFFFAOYSA-N
• XLogP: 16.35
• TPSA: 369.33 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 30
• Rotatable Bonds: 24
• Heavy Atoms: 159
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2359.39
LogP ≤ 5	16.35
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	30

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyrazin-3-yl]methyl]-1,3,4,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-6-one;4-[[2-(4-chlorophenyl)-6-methylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;1-[4-[[2-(4-chlorophenyl)-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;1-[4-[[2-(4-chlorophenyl)-6-pyrrolidin-1-ylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;N-[2-(2,4-dichlorophenyl)-3-[[4-(2-hydroxy-2-methylpropanoyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]-N-methylmethanesulfonamide?

The IUPAC name of 2-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyrazin-3-yl]methyl]-1,3,4,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-6-one;4-[[2-(4-chlorophenyl)-6-methylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;1-[4-[[2-(4-chlorophenyl)-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;1-[4-[[2-(4-chlorophenyl)-6-pyrrolidin-1-ylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;N-[2-(2,4-dichlorophenyl)-3-[[4-(2-hydroxy-2-methylpropanoyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]-N-methylmethanesulfonamide (CID 159077869) is 2-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyrazin-3-yl]methyl]-1,3,4,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-6-one;4-[[2-(4-chlorophenyl)-6-methylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;1-[4-[[2-(4-chlorophenyl)-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;1-[4-[[2-(4-chlorophenyl)-6-pyrrolidin-1-ylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;N-[2-(2,4-dichlorophenyl)-3-[[4-(2-hydroxy-2-methylpropanoyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]-N-methylmethanesulfonamide.

What is the SMILES notation for 2-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyrazin-3-yl]methyl]-1,3,4,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-6-one;4-[[2-(4-chlorophenyl)-6-methylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;1-[4-[[2-(4-chlorophenyl)-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;1-[4-[[2-(4-chlorophenyl)-6-pyrrolidin-1-ylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;N-[2-(2,4-dichlorophenyl)-3-[[4-(2-hydroxy-2-methylpropanoyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]-N-methylmethanesulfonamide?

The canonical SMILES for 2-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyrazin-3-yl]methyl]-1,3,4,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-6-one;4-[[2-(4-chlorophenyl)-6-methylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;1-[4-[[2-(4-chlorophenyl)-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;1-[4-[[2-(4-chlorophenyl)-6-pyrrolidin-1-ylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;N-[2-(2,4-dichlorophenyl)-3-[[4-(2-hydroxy-2-methylpropanoyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]-N-methylmethanesulfonamide is CC(=O)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(S(=O)(=O)C(C)C)cn23)CC1.CC(=O)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(S(=O)(=O)N4CCCC4)cn23)CC1.CN(c1ccc2nc(-c3ccc(Cl)cc3Cl)c(CN3CCN(C(=O)C(C)(C)O)CC3)n2c1)S(C)(=O)=O.CS(=O)(=O)c1ccc2nc(-c3ccc(Cl)cc3)c(CN3CCOCC3)n2c1.O=C1CCC2CN(Cc3c(-c4ccc(Cl)cc4)nc4cnc(C5CC5)cn34)CCN12.

What is the InChIKey of 2-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyrazin-3-yl]methyl]-1,3,4,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-6-one;4-[[2-(4-chlorophenyl)-6-methylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;1-[4-[[2-(4-chlorophenyl)-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;1-[4-[[2-(4-chlorophenyl)-6-pyrrolidin-1-ylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;N-[2-(2,4-dichlorophenyl)-3-[[4-(2-hydroxy-2-methylpropanoyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]-N-methylmethanesulfonamide?

The InChIKey is KALZEVZNEYWTJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29Cl2N5O4S.C24H28ClN5O3S.C23H24ClN5O.C23H27ClN4O3S.C19H20ClN3O3S/c1-24(2,33)23(32)30-11-9-29(10-12-30)15-20-22(18-7-5-16(25)13-19(18)26)27-21-8-6-17(14-31(20)21)28(3)36(4,34)35;1-18(31)28-14-12-27(13-15-28)17-22-24(19-4-6-20(25)7-5-19)26-23-9-8-21(16-30(22)23)34(32,33)29-10-2-3-11-29;24-17-5-3-16(4-6-17)23-20(14-27-9-10-28-18(12-27)7-8-22(28)30)29-13-19(15-1-2-15)25-11-21(29)26-23;1-16(2)32(30,31)20-8-9-22-25-23(18-4-6-19(24)7-5-18)21(28(22)14-20)15-26-10-12-27(13-11-26)17(3)29;1-27(24,25)16-6-7-18-21-19(14-2-4-15(20)5-3-14)17(23(18)12-16)13-22-8-10-26-11-9-22/h5-8,13-14,33H,9-12,15H2,1-4H3;4-9,16H,2-3,10-15,17H2,1H3;3-6,11,13,15,18H,1-2,7-10,12,14H2;4-9,14,16H,10-13,15H2,1-3H3;2-7,12H,8-11,13H2,1H3.

What are the key properties of 2-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyrazin-3-yl]methyl]-1,3,4,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-6-one;4-[[2-(4-chlorophenyl)-6-methylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;1-[4-[[2-(4-chlorophenyl)-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;1-[4-[[2-(4-chlorophenyl)-6-pyrrolidin-1-ylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;N-[2-(2,4-dichlorophenyl)-3-[[4-(2-hydroxy-2-methylpropanoyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]-N-methylmethanesulfonamide?

2-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyrazin-3-yl]methyl]-1,3,4,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-6-one;4-[[2-(4-chlorophenyl)-6-methylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;1-[4-[[2-(4-chlorophenyl)-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;1-[4-[[2-(4-chlorophenyl)-6-pyrrolidin-1-ylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;N-[2-(2,4-dichlorophenyl)-3-[[4-(2-hydroxy-2-methylpropanoyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]-N-methylmethanesulfonamide has a molecular weight of 2359.39 g/mol, XLogP of 16.35, 24 rotatable bonds, 1 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyrazin-3-yl]methyl]-1,3,4,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-6-one;4-[[2-(4-chlorophenyl)-6-methylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;1-[4-[[2-(4-chlorophenyl)-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;1-[4-[[2-(4-chlorophenyl)-6-pyrrolidin-1-ylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;N-[2-(2,4-dichlorophenyl)-3-[[4-(2-hydroxy-2-methylpropanoyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]-N-methylmethanesulfonamide is sourced from PubChem (CID 159077869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).