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

C124H117Cl4N21O13 — CID 158165206

About 5'-(5-chloro-2-methylphenyl)-2'-(6-ethoxy-2-methoxy-3-pyridinyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(4-cyclopropyl-2-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(6-cyclopropyl-4-methoxy-3-pyridinyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(2-methoxy-4-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'-(6-ethoxy-2-methoxy-3-pyridinyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(4-cyclopropyl-2-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(6-cyclopropyl-4-methoxy-3-pyridinyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(2-methoxy-4-methylphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione (PubChem CID 158165206) has the molecular formula C124H117Cl4N21O13 and a molecular weight of 2251.25 g/mol. Its IUPAC name is 5'-(5-chloro-2-methylphenyl)-2'-(6-ethoxy-2-methoxy-3-pyridinyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(4-cyclopropyl-2-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(6-cyclopropyl-4-methoxy-3-pyridinyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(2-methoxy-4-methylphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione.

Molecular Properties

• Compound Name: 5'-(5-chloro-2-methylphenyl)-2'-(6-ethoxy-2-methoxy-3-pyridinyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(4-cyclopropyl-2-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(6-cyclopropyl-4-methoxy-3-pyridinyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(2-methoxy-4-methylphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione
• PubChem CID: 158165206
• Molecular Formula: C124H117Cl4N21O13
• Molecular Weight: 2251.25 g/mol
• Exact Mass: 2247.79
• IUPAC Name: 5'-(5-chloro-2-methylphenyl)-2'-(6-ethoxy-2-methoxy-3-pyridinyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(4-cyclopropyl-2-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(6-cyclopropyl-4-methoxy-3-pyridinyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(2-methoxy-4-methylphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione
• SMILES: CCOc1ccc(-c2nc3c(n2C(C)C)C2(C(=O)Nc4cc(C)ccc42)N(c2cc(Cl)ccc2C)C3=O)c(OC)n1.COc1cc(C)ccc1-c1nc2c(n1C(C)C)C1(C(=O)Nc3cc(C)ccc31)N(c1cc(Cl)cnc1C)C2=O.COc1cc(C2CC2)ccc1-c1nc2c(n1C(C)C)C1(C(=O)Nc3cc(C)ccc31)N(c1cc(Cl)cnc1C)C2=O.COc1cc(C2CC2)ncc1-c1nc2c(n1C(C)C)C1(C(=O)Nc3cc(C)ccc31)N(c1cc(Cl)cnc1C)C2=O
• InChI: InChI=1S/C32H30ClN5O3.C31H29ClN6O3.C31H30ClN5O4.C30H28ClN5O3/c1-16(2)37-28-27(36-29(37)22-10-9-20(19-7-8-19)13-26(22)41-5)30(39)38(25-14-21(33)15-34-18(25)4)32(28)23-11-6-17(3)12-24(23)35-31(32)40;1-15(2)37-27-26(36-28(37)20-14-34-22(18-7-8-18)12-25(20)41-5)29(39)38(24-11-19(32)13-33-17(24)4)31(27)21-9-6-16(3)10-23(21)35-30(31)40;1-7-41-24-13-11-20(28(34-24)40-6)27-35-25-26(36(27)16(2)3)31(21-12-8-17(4)14-22(21)33-30(31)39)37(29(25)38)23-15-19(32)10-9-18(23)5;1-15(2)35-26-25(34-27(35)20-9-7-17(4)12-24(20)39-6)28(37)36(23-13-19(31)14-32-18(23)5)30(26)21-10-8-16(3)11-22(21)33-29(30)38/h6,9-16,19H,7-8H2,1-5H3,(H,35,40);6,9-15,18H,7-8H2,1-5H3,(H,35,40);8-16H,7H2,1-6H3,(H,33,39);7-15H,1-6H3,(H,33,38)
• InChIKey: FWTHFZPGERBQIQ-UHFFFAOYSA-N
• XLogP: 24.50
• TPSA: 379.52 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 26
• Rotatable Bonds: 20
• Heavy Atoms: 162
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2251.25
LogP ≤ 5	24.50
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	26

Frequently Asked Questions

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

The IUPAC name of 5'-(5-chloro-2-methylphenyl)-2'-(6-ethoxy-2-methoxy-3-pyridinyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(4-cyclopropyl-2-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(6-cyclopropyl-4-methoxy-3-pyridinyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(2-methoxy-4-methylphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione (CID 158165206) is 5'-(5-chloro-2-methylphenyl)-2'-(6-ethoxy-2-methoxy-3-pyridinyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(4-cyclopropyl-2-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(6-cyclopropyl-4-methoxy-3-pyridinyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(2-methoxy-4-methylphenyl)-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'-(5-chloro-2-methylphenyl)-2'-(6-ethoxy-2-methoxy-3-pyridinyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(4-cyclopropyl-2-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(6-cyclopropyl-4-methoxy-3-pyridinyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(2-methoxy-4-methylphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione?

The canonical SMILES for 5'-(5-chloro-2-methylphenyl)-2'-(6-ethoxy-2-methoxy-3-pyridinyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(4-cyclopropyl-2-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(6-cyclopropyl-4-methoxy-3-pyridinyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(2-methoxy-4-methylphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione is CCOc1ccc(-c2nc3c(n2C(C)C)C2(C(=O)Nc4cc(C)ccc42)N(c2cc(Cl)ccc2C)C3=O)c(OC)n1.COc1cc(C)ccc1-c1nc2c(n1C(C)C)C1(C(=O)Nc3cc(C)ccc31)N(c1cc(Cl)cnc1C)C2=O.COc1cc(C2CC2)ccc1-c1nc2c(n1C(C)C)C1(C(=O)Nc3cc(C)ccc31)N(c1cc(Cl)cnc1C)C2=O.COc1cc(C2CC2)ncc1-c1nc2c(n1C(C)C)C1(C(=O)Nc3cc(C)ccc31)N(c1cc(Cl)cnc1C)C2=O.

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

The InChIKey is FWTHFZPGERBQIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H30ClN5O3.C31H29ClN6O3.C31H30ClN5O4.C30H28ClN5O3/c1-16(2)37-28-27(36-29(37)22-10-9-20(19-7-8-19)13-26(22)41-5)30(39)38(25-14-21(33)15-34-18(25)4)32(28)23-11-6-17(3)12-24(23)35-31(32)40;1-15(2)37-27-26(36-28(37)20-14-34-22(18-7-8-18)12-25(20)41-5)29(39)38(24-11-19(32)13-33-17(24)4)31(27)21-9-6-16(3)10-23(21)35-30(31)40;1-7-41-24-13-11-20(28(34-24)40-6)27-35-25-26(36(27)16(2)3)31(21-12-8-17(4)14-22(21)33-30(31)39)37(29(25)38)23-15-19(32)10-9-18(23)5;1-15(2)35-26-25(34-27(35)20-9-7-17(4)12-24(20)39-6)28(37)36(23-13-19(31)14-32-18(23)5)30(26)21-10-8-16(3)11-22(21)33-29(30)38/h6,9-16,19H,7-8H2,1-5H3,(H,35,40);6,9-15,18H,7-8H2,1-5H3,(H,35,40);8-16H,7H2,1-6H3,(H,33,39);7-15H,1-6H3,(H,33,38).

What are the key properties of 5'-(5-chloro-2-methylphenyl)-2'-(6-ethoxy-2-methoxy-3-pyridinyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(4-cyclopropyl-2-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(6-cyclopropyl-4-methoxy-3-pyridinyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(2-methoxy-4-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'-(6-ethoxy-2-methoxy-3-pyridinyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(4-cyclopropyl-2-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(6-cyclopropyl-4-methoxy-3-pyridinyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(2-methoxy-4-methylphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione has a molecular weight of 2251.25 g/mol, XLogP of 24.50, 20 rotatable bonds, 4 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 5'-(5-chloro-2-methylphenyl)-2'-(6-ethoxy-2-methoxy-3-pyridinyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(4-cyclopropyl-2-methoxyphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(6-cyclopropyl-4-methoxy-3-pyridinyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione;5'-(5-chloro-2-methyl-3-pyridinyl)-2'-(2-methoxy-4-methylphenyl)-6-methyl-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione is sourced from PubChem (CID 158165206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).