5'-(4-acetyl-3-chlorophenyl)-6-chloro-2'-(4,6-dimethoxy-3-pyridinyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;2'-(4-amino-2-methoxyphenyl)-5'-(5-chloro-2-fluorophenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(3-chloro-4-methoxyphenyl)-2'-(2-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methylphenyl)-2'-(2-methoxy-5-methylphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methylphenyl)-2'-(4-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione

C150H133Cl6FN22O18 — CID 157478135

About 5'-(4-acetyl-3-chlorophenyl)-6-chloro-2'-(4,6-dimethoxy-3-pyridinyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;2'-(4-amino-2-methoxyphenyl)-5'-(5-chloro-2-fluorophenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(3-chloro-4-methoxyphenyl)-2'-(2-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methylphenyl)-2'-(2-methoxy-5-methylphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methylphenyl)-2'-(4-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione

5'-(4-acetyl-3-chlorophenyl)-6-chloro-2'-(4,6-dimethoxy-3-pyridinyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;2'-(4-amino-2-methoxyphenyl)-5'-(5-chloro-2-fluorophenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(3-chloro-4-methoxyphenyl)-2'-(2-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methylphenyl)-2'-(2-methoxy-5-methylphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methylphenyl)-2'-(4-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione (PubChem CID 157478135) has the molecular formula C150H133Cl6FN22O18 and a molecular weight of 2763.57 g/mol. Its IUPAC name is 5'-(4-acetyl-3-chlorophenyl)-6-chloro-2'-(4,6-dimethoxy-3-pyridinyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;2'-(4-amino-2-methoxyphenyl)-5'-(5-chloro-2-fluorophenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(3-chloro-4-methoxyphenyl)-2'-(2-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methylphenyl)-2'-(2-methoxy-5-methylphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methylphenyl)-2'-(4-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione.

Molecular Properties

• Compound Name: 5'-(4-acetyl-3-chlorophenyl)-6-chloro-2'-(4,6-dimethoxy-3-pyridinyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;2'-(4-amino-2-methoxyphenyl)-5'-(5-chloro-2-fluorophenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(3-chloro-4-methoxyphenyl)-2'-(2-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methylphenyl)-2'-(2-methoxy-5-methylphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methylphenyl)-2'-(4-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione
• PubChem CID: 157478135
• Molecular Formula: C150H133Cl6FN22O18
• Molecular Weight: 2763.57 g/mol
• Exact Mass: 2758.83
• IUPAC Name: 5'-(4-acetyl-3-chlorophenyl)-6-chloro-2'-(4,6-dimethoxy-3-pyridinyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;2'-(4-amino-2-methoxyphenyl)-5'-(5-chloro-2-fluorophenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(3-chloro-4-methoxyphenyl)-2'-(2-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methylphenyl)-2'-(2-methoxy-5-methylphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methylphenyl)-2'-(4-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione
• SMILES: COc1cc(N)ccc1-c1nc2c(n1C(C)C)C1(C(=O)Nc3cc(C)ccc31)N(c1cc(Cl)ccc1F)C2=O.COc1cc(OC)c(-c2nc3c(n2C(C)C)C2(C(=O)Nc4cc(Cl)ccc42)N(c2ccc(C(C)=O)c(Cl)c2)C3=O)cn1.COc1ccc(-c2nc3c(n2C(C)C)C2(C(=O)Nc4cc(C)ccc42)N(c2cc(Cl)ccc2C)C3=O)cc1.COc1ccc(C)cc1-c1nc2c(n1C(C)C)C1(C(=O)Nc3cc(C)ccc31)N(c1cc(Cl)ccc1C)C2=O.COc1ccc(N2C(=O)c3nc(-c4ccccc4OC)n(C(C)C)c3C23C(=O)Nc2cc(C)ccc23)cc1Cl
• InChI: InChI=1S/C31H29ClN4O3.C30H25Cl2N5O5.C30H27ClN4O4.C30H27ClN4O3.C29H25ClFN5O3/c1-16(2)35-27-26(34-28(35)21-13-17(3)8-12-25(21)39-6)29(37)36(24-15-20(32)10-9-19(24)5)31(27)22-11-7-18(4)14-23(22)33-30(31)38;1-14(2)36-26-25(35-27(36)19-13-33-24(42-5)12-23(19)41-4)28(39)37(17-7-8-18(15(3)38)21(32)11-17)30(26)20-9-6-16(31)10-22(20)34-29(30)40;1-16(2)34-26-25(33-27(34)19-8-6-7-9-23(19)38-4)28(36)35(18-11-13-24(39-5)21(31)15-18)30(26)20-12-10-17(3)14-22(20)32-29(30)37;1-16(2)34-26-25(33-27(34)19-8-11-21(38-5)12-9-19)28(36)35(24-15-20(31)10-7-18(24)4)30(26)22-13-6-17(3)14-23(22)32-29(30)37;1-14(2)35-25-24(34-26(35)18-8-7-17(32)13-23(18)39-4)27(37)36(22-12-16(30)6-10-20(22)31)29(25)19-9-5-15(3)11-21(19)33-28(29)38/h7-16H,1-6H3,(H,33,38);6-14H,1-5H3,(H,34,40);6-16H,1-5H3,(H,32,37);6-16H,1-5H3,(H,32,37);5-14H,32H2,1-4H3,(H,33,38)
• InChIKey: BVVLUPAHZVCGBE-UHFFFAOYSA-N
• XLogP: 30.39
• TPSA: 456.74 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 30
• Rotatable Bonds: 23
• Heavy Atoms: 197
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2763.57
LogP ≤ 5	30.39
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	30

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'aniline', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5'-(4-acetyl-3-chlorophenyl)-6-chloro-2'-(4,6-dimethoxy-3-pyridinyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;2'-(4-amino-2-methoxyphenyl)-5'-(5-chloro-2-fluorophenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(3-chloro-4-methoxyphenyl)-2'-(2-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methylphenyl)-2'-(2-methoxy-5-methylphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methylphenyl)-2'-(4-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione?

The IUPAC name of 5'-(4-acetyl-3-chlorophenyl)-6-chloro-2'-(4,6-dimethoxy-3-pyridinyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;2'-(4-amino-2-methoxyphenyl)-5'-(5-chloro-2-fluorophenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(3-chloro-4-methoxyphenyl)-2'-(2-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methylphenyl)-2'-(2-methoxy-5-methylphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methylphenyl)-2'-(4-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione (CID 157478135) is 5'-(4-acetyl-3-chlorophenyl)-6-chloro-2'-(4,6-dimethoxy-3-pyridinyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;2'-(4-amino-2-methoxyphenyl)-5'-(5-chloro-2-fluorophenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(3-chloro-4-methoxyphenyl)-2'-(2-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methylphenyl)-2'-(2-methoxy-5-methylphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methylphenyl)-2'-(4-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione.

What is the SMILES notation for 5'-(4-acetyl-3-chlorophenyl)-6-chloro-2'-(4,6-dimethoxy-3-pyridinyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;2'-(4-amino-2-methoxyphenyl)-5'-(5-chloro-2-fluorophenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(3-chloro-4-methoxyphenyl)-2'-(2-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methylphenyl)-2'-(2-methoxy-5-methylphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methylphenyl)-2'-(4-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione?

The canonical SMILES for 5'-(4-acetyl-3-chlorophenyl)-6-chloro-2'-(4,6-dimethoxy-3-pyridinyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;2'-(4-amino-2-methoxyphenyl)-5'-(5-chloro-2-fluorophenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(3-chloro-4-methoxyphenyl)-2'-(2-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methylphenyl)-2'-(2-methoxy-5-methylphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methylphenyl)-2'-(4-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione is COc1cc(N)ccc1-c1nc2c(n1C(C)C)C1(C(=O)Nc3cc(C)ccc31)N(c1cc(Cl)ccc1F)C2=O.COc1cc(OC)c(-c2nc3c(n2C(C)C)C2(C(=O)Nc4cc(Cl)ccc42)N(c2ccc(C(C)=O)c(Cl)c2)C3=O)cn1.COc1ccc(-c2nc3c(n2C(C)C)C2(C(=O)Nc4cc(C)ccc42)N(c2cc(Cl)ccc2C)C3=O)cc1.COc1ccc(C)cc1-c1nc2c(n1C(C)C)C1(C(=O)Nc3cc(C)ccc31)N(c1cc(Cl)ccc1C)C2=O.COc1ccc(N2C(=O)c3nc(-c4ccccc4OC)n(C(C)C)c3C23C(=O)Nc2cc(C)ccc23)cc1Cl.

What is the InChIKey of 5'-(4-acetyl-3-chlorophenyl)-6-chloro-2'-(4,6-dimethoxy-3-pyridinyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;2'-(4-amino-2-methoxyphenyl)-5'-(5-chloro-2-fluorophenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(3-chloro-4-methoxyphenyl)-2'-(2-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methylphenyl)-2'-(2-methoxy-5-methylphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methylphenyl)-2'-(4-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione?

The InChIKey is BVVLUPAHZVCGBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H29ClN4O3.C30H25Cl2N5O5.C30H27ClN4O4.C30H27ClN4O3.C29H25ClFN5O3/c1-16(2)35-27-26(34-28(35)21-13-17(3)8-12-25(21)39-6)29(37)36(24-15-20(32)10-9-19(24)5)31(27)22-11-7-18(4)14-23(22)33-30(31)38;1-14(2)36-26-25(35-27(36)19-13-33-24(42-5)12-23(19)41-4)28(39)37(17-7-8-18(15(3)38)21(32)11-17)30(26)20-9-6-16(31)10-22(20)34-29(30)40;1-16(2)34-26-25(33-27(34)19-8-6-7-9-23(19)38-4)28(36)35(18-11-13-24(39-5)21(31)15-18)30(26)20-12-10-17(3)14-22(20)32-29(30)37;1-16(2)34-26-25(33-27(34)19-8-11-21(38-5)12-9-19)28(36)35(24-15-20(31)10-7-18(24)4)30(26)22-13-6-17(3)14-23(22)32-29(30)37;1-14(2)35-25-24(34-26(35)18-8-7-17(32)13-23(18)39-4)27(37)36(22-12-16(30)6-10-20(22)31)29(25)19-9-5-15(3)11-21(19)33-28(29)38/h7-16H,1-6H3,(H,33,38);6-14H,1-5H3,(H,34,40);6-16H,1-5H3,(H,32,37);6-16H,1-5H3,(H,32,37);5-14H,32H2,1-4H3,(H,33,38).

What are the key properties of 5'-(4-acetyl-3-chlorophenyl)-6-chloro-2'-(4,6-dimethoxy-3-pyridinyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;2'-(4-amino-2-methoxyphenyl)-5'-(5-chloro-2-fluorophenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(3-chloro-4-methoxyphenyl)-2'-(2-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methylphenyl)-2'-(2-methoxy-5-methylphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methylphenyl)-2'-(4-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione?

5'-(4-acetyl-3-chlorophenyl)-6-chloro-2'-(4,6-dimethoxy-3-pyridinyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;2'-(4-amino-2-methoxyphenyl)-5'-(5-chloro-2-fluorophenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(3-chloro-4-methoxyphenyl)-2'-(2-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methylphenyl)-2'-(2-methoxy-5-methylphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methylphenyl)-2'-(4-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione has a molecular weight of 2763.57 g/mol, XLogP of 30.39, 23 rotatable bonds, 6 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for 5'-(4-acetyl-3-chlorophenyl)-6-chloro-2'-(4,6-dimethoxy-3-pyridinyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;2'-(4-amino-2-methoxyphenyl)-5'-(5-chloro-2-fluorophenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(3-chloro-4-methoxyphenyl)-2'-(2-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methylphenyl)-2'-(2-methoxy-5-methylphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methylphenyl)-2'-(4-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione is sourced from PubChem (CID 157478135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).