2-propan-2-yl-7-(2-propan-2-yl-1,4-dihydroindeno[2,1-b]pyrrol-6-yl)-1H-benzo[e]indole;6-propan-2-yl-16-(2-propan-2-yl-1H-imidazol-5-yl)-7-azapentacyclo[10.7.0.03,10.04,8.013,18]nonadeca-1,3(10),4(8),6,11,13(18),14,16-octaene;2-propan-2-yl-6-[4-(2-propan-2-yl-1H-imidazol-5-yl)phenyl]-1,4-dihydroindeno[2,1-b]pyrrole;2-propan-2-yl-5-[4-[4-(2-propan-2-yl-3H-pyrrol-4-yl)phenyl]phenyl]-1H-imidazole;2-propan-2-yl-5-[9-(2-propan-2-yl-3H-pyrrol-4-yl)-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7(12),8,10-hexaenyl]-1H-imidazole

C134H136N14 — CID 162140714

IUPAC2-propan-2-yl-7-(2-propan-2-yl-1,4-dihydroindeno[2,1-b]pyrrol-6-yl)-1H-benzo[e]indole;6-propan-2-yl-16-(2-propan-2-yl-1H-imidazol-5-yl)-7-azapentacyclo[10.7.0.03,10.04,8.013,18]nonadeca-1,3(10),4(8),6,11,13(18),14,16-octaene;2-propan-2-yl-6-[4-(2-propan-2-yl-1H-imidazol-5-yl)phenyl]-1,4-dihydroindeno[2,1-b]pyrrole;2-propan-2-yl-5-[4-[4-(2-propan-2-yl-3H-pyrrol-4-yl)phenyl]phenyl]-1H-imidazole;2-propan-2-yl-5-[9-(2-propan-2-yl-3H-pyrrol-4-yl)-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7(12),8,10-hexaenyl]-1H-imidazole
SMILESCC(C)C1=NC2=C(C1)c1cc3c(cc1C2)-c1ccc(-c2cnc(C(C)C)[nH]2)cc1C3.CC(C)C1=NC2=C(C1)c1ccc(-c3ccc(-c4cnc(C(C)C)[nH]4)cc3)cc1C2.CC(C)C1=NC2=C(C1)c1ccc(-c3ccc4c5c(ccc4c3)N=C(C(C)C)C5)cc1C2.CC(C)C1=NC=C(c2cc3c4c(c2)Cc2cc(-c5cnc(C(C)C)[nH]5)cc(c2-4)C3)C1.CC(C)C1=NC=C(c2ccc(-c3ccc(-c4cnc(C(C)C)[nH]4)cc3)cc2)C1
InChIInChI=1S/C29H28N2.2C27H27N3.C26H27N3.C25H27N3/c1-16(2)27-14-24-22-8-5-18(11-20(22)7-10-26(24)30-27)19-6-9-23-21(12-19)13-29-25(23)15-28(31-29)17(3)4;1-14(2)23-11-22(12-28-23)16-5-18-9-20-7-17(24-13-29-27(30-24)15(3)4)8-21-10-19(6-16)25(18)26(20)21;1-14(2)24-12-23-22-9-18-8-17-7-16(26-13-28-27(30-26)15(3)4)5-6-20(17)21(18)10-19(22)11-25(23)29-24;1-15(2)23-13-22-21-10-9-19(11-20(21)12-24(22)28-23)17-5-7-18(8-6-17)25-14-27-26(29-25)16(3)4;1-16(2)23-13-22(14-26-23)20-7-5-18(6-8-20)19-9-11-21(12-10-19)24-15-27-25(28-24)17(3)4/h5-12,16-17H,13-15H2,1-4H3;5-8,12-15H,9-11H2,1-4H3,(H,29,30);5-7,9-10,13-15H,8,11-12H2,1-4H3,(H,28,30);5-11,14-16H,12-13H2,1-4H3,(H,27,29);5-12,14-17H,13H2,1-4H3,(H,27,28)
InChIKeyZJWSTUANPLMINU-UHFFFAOYSA-N
MW1942.66 g/mol
LogP33.96
Rot. Bonds19

About 2-propan-2-yl-7-(2-propan-2-yl-1,4-dihydroindeno[2,1-b]pyrrol-6-yl)-1H-benzo[e]indole;6-propan-2-yl-16-(2-propan-2-yl-1H-imidazol-5-yl)-7-azapentacyclo[10.7.0.03,10.04,8.013,18]nonadeca-1,3(10),4(8),6,11,13(18),14,16-octaene;2-propan-2-yl-6-[4-(2-propan-2-yl-1H-imidazol-5-yl)phenyl]-1,4-dihydroindeno[2,1-b]pyrrole;2-propan-2-yl-5-[4-[4-(2-propan-2-yl-3H-pyrrol-4-yl)phenyl]phenyl]-1H-imidazole;2-propan-2-yl-5-[9-(2-propan-2-yl-3H-pyrrol-4-yl)-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7(12),8,10-hexaenyl]-1H-imidazole

2-propan-2-yl-7-(2-propan-2-yl-1,4-dihydroindeno[2,1-b]pyrrol-6-yl)-1H-benzo[e]indole;6-propan-2-yl-16-(2-propan-2-yl-1H-imidazol-5-yl)-7-azapentacyclo[10.7.0.03,10.04,8.013,18]nonadeca-1,3(10),4(8),6,11,13(18),14,16-octaene;2-propan-2-yl-6-[4-(2-propan-2-yl-1H-imidazol-5-yl)phenyl]-1,4-dihydroindeno[2,1-b]pyrrole;2-propan-2-yl-5-[4-[4-(2-propan-2-yl-3H-pyrrol-4-yl)phenyl]phenyl]-1H-imidazole;2-propan-2-yl-5-[9-(2-propan-2-yl-3H-pyrrol-4-yl)-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7(12),8,10-hexaenyl]-1H-imidazole (PubChem CID 162140714) has the molecular formula C134H136N14 and a molecular weight of 1942.66 g/mol. Its IUPAC name is 2-propan-2-yl-7-(2-propan-2-yl-1,4-dihydroindeno[2,1-b]pyrrol-6-yl)-1H-benzo[e]indole;6-propan-2-yl-16-(2-propan-2-yl-1H-imidazol-5-yl)-7-azapentacyclo[10.7.0.03,10.04,8.013,18]nonadeca-1,3(10),4(8),6,11,13(18),14,16-octaene;2-propan-2-yl-6-[4-(2-propan-2-yl-1H-imidazol-5-yl)phenyl]-1,4-dihydroindeno[2,1-b]pyrrole;2-propan-2-yl-5-[4-[4-(2-propan-2-yl-3H-pyrrol-4-yl)phenyl]phenyl]-1H-imidazole;2-propan-2-yl-5-[9-(2-propan-2-yl-3H-pyrrol-4-yl)-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7(12),8,10-hexaenyl]-1H-imidazole.

Molecular Properties

Compound Name2-propan-2-yl-7-(2-propan-2-yl-1,4-dihydroindeno[2,1-b]pyrrol-6-yl)-1H-benzo[e]indole;6-propan-2-yl-16-(2-propan-2-yl-1H-imidazol-5-yl)-7-azapentacyclo[10.7.0.03,10.04,8.013,18]nonadeca-1,3(10),4(8),6,11,13(18),14,16-octaene;2-propan-2-yl-6-[4-(2-propan-2-yl-1H-imidazol-5-yl)phenyl]-1,4-dihydroindeno[2,1-b]pyrrole;2-propan-2-yl-5-[4-[4-(2-propan-2-yl-3H-pyrrol-4-yl)phenyl]phenyl]-1H-imidazole;2-propan-2-yl-5-[9-(2-propan-2-yl-3H-pyrrol-4-yl)-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7(12),8,10-hexaenyl]-1H-imidazole
PubChem CID162140714
Molecular FormulaC134H136N14
Molecular Weight1942.66 g/mol
Exact Mass1941.11
IUPAC Name2-propan-2-yl-7-(2-propan-2-yl-1,4-dihydroindeno[2,1-b]pyrrol-6-yl)-1H-benzo[e]indole;6-propan-2-yl-16-(2-propan-2-yl-1H-imidazol-5-yl)-7-azapentacyclo[10.7.0.03,10.04,8.013,18]nonadeca-1,3(10),4(8),6,11,13(18),14,16-octaene;2-propan-2-yl-6-[4-(2-propan-2-yl-1H-imidazol-5-yl)phenyl]-1,4-dihydroindeno[2,1-b]pyrrole;2-propan-2-yl-5-[4-[4-(2-propan-2-yl-3H-pyrrol-4-yl)phenyl]phenyl]-1H-imidazole;2-propan-2-yl-5-[9-(2-propan-2-yl-3H-pyrrol-4-yl)-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7(12),8,10-hexaenyl]-1H-imidazole
SMILESCC(C)C1=NC2=C(C1)c1cc3c(cc1C2)-c1ccc(-c2cnc(C(C)C)[nH]2)cc1C3.CC(C)C1=NC2=C(C1)c1ccc(-c3ccc(-c4cnc(C(C)C)[nH]4)cc3)cc1C2.CC(C)C1=NC2=C(C1)c1ccc(-c3ccc4c5c(ccc4c3)N=C(C(C)C)C5)cc1C2.CC(C)C1=NC=C(c2cc3c4c(c2)Cc2cc(-c5cnc(C(C)C)[nH]5)cc(c2-4)C3)C1.CC(C)C1=NC=C(c2ccc(-c3ccc(-c4cnc(C(C)C)[nH]4)cc3)cc2)C1
InChIInChI=1S/C29H28N2.2C27H27N3.C26H27N3.C25H27N3/c1-16(2)27-14-24-22-8-5-18(11-20(22)7-10-26(24)30-27)19-6-9-23-21(12-19)13-29-25(23)15-28(31-29)17(3)4;1-14(2)23-11-22(12-28-23)16-5-18-9-20-7-17(24-13-29-27(30-24)15(3)4)8-21-10-19(6-16)25(18)26(20)21;1-14(2)24-12-23-22-9-18-8-17-7-16(26-13-28-27(30-26)15(3)4)5-6-20(17)21(18)10-19(22)11-25(23)29-24;1-15(2)23-13-22-21-10-9-19(11-20(21)12-24(22)28-23)17-5-7-18(8-6-17)25-14-27-26(29-25)16(3)4;1-16(2)23-13-22(14-26-23)20-7-5-18(6-8-20)19-9-11-21(12-10-19)24-15-27-25(28-24)17(3)4/h5-12,16-17H,13-15H2,1-4H3;5-8,12-15H,9-11H2,1-4H3,(H,29,30);5-7,9-10,13-15H,8,11-12H2,1-4H3,(H,28,30);5-11,14-16H,12-13H2,1-4H3,(H,27,29);5-12,14-17H,13H2,1-4H3,(H,27,28)
InChIKeyZJWSTUANPLMINU-UHFFFAOYSA-N
XLogP33.96
TPSA188.88 Ų
H-Bond Donors4
H-Bond Acceptors10
Rotatable Bonds19
Heavy Atoms148
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001942.66
LogP ≤ 533.96
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1010

Analyze 2-propan-2-yl-7-(2-propan-2-yl-1,4-dihydroindeno[2,1-b]pyrrol-6-yl)-1H-benzo[e]indole;6-propan-2-yl-16-(2-propan-2-yl-1H-imidazol-5-yl)-7-azapentacyclo[10.7.0.03,10.04,8.013,18]nonadeca-1,3(10),4(8),6,11,13(18),14,16-octaene;2-propan-2-yl-6-[4-(2-propan-2-yl-1H-imidazol-5-yl)phenyl]-1,4-dihydroindeno[2,1-b]pyrrole;2-propan-2-yl-5-[4-[4-(2-propan-2-yl-3H-pyrrol-4-yl)phenyl]phenyl]-1H-imidazole;2-propan-2-yl-5-[9-(2-propan-2-yl-3H-pyrrol-4-yl)-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7(12),8,10-hexaenyl]-1H-imidazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yl-7-(2-propan-2-yl-1,4-dihydroindeno[2,1-b]pyrrol-6-yl)-1H-benzo[e]indole;6-propan-2-yl-16-(2-propan-2-yl-1H-imidazol-5-yl)-7-azapentacyclo[10.7.0.03,10.04,8.013,18]nonadeca-1,3(10),4(8),6,11,13(18),14,16-octaene;2-propan-2-yl-6-[4-(2-propan-2-yl-1H-imidazol-5-yl)phenyl]-1,4-dihydroindeno[2,1-b]pyrrole;2-propan-2-yl-5-[4-[4-(2-propan-2-yl-3H-pyrrol-4-yl)phenyl]phenyl]-1H-imidazole;2-propan-2-yl-5-[9-(2-propan-2-yl-3H-pyrrol-4-yl)-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7(12),8,10-hexaenyl]-1H-imidazole?
The IUPAC name of 2-propan-2-yl-7-(2-propan-2-yl-1,4-dihydroindeno[2,1-b]pyrrol-6-yl)-1H-benzo[e]indole;6-propan-2-yl-16-(2-propan-2-yl-1H-imidazol-5-yl)-7-azapentacyclo[10.7.0.03,10.04,8.013,18]nonadeca-1,3(10),4(8),6,11,13(18),14,16-octaene;2-propan-2-yl-6-[4-(2-propan-2-yl-1H-imidazol-5-yl)phenyl]-1,4-dihydroindeno[2,1-b]pyrrole;2-propan-2-yl-5-[4-[4-(2-propan-2-yl-3H-pyrrol-4-yl)phenyl]phenyl]-1H-imidazole;2-propan-2-yl-5-[9-(2-propan-2-yl-3H-pyrrol-4-yl)-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7(12),8,10-hexaenyl]-1H-imidazole (CID 162140714) is 2-propan-2-yl-7-(2-propan-2-yl-1,4-dihydroindeno[2,1-b]pyrrol-6-yl)-1H-benzo[e]indole;6-propan-2-yl-16-(2-propan-2-yl-1H-imidazol-5-yl)-7-azapentacyclo[10.7.0.03,10.04,8.013,18]nonadeca-1,3(10),4(8),6,11,13(18),14,16-octaene;2-propan-2-yl-6-[4-(2-propan-2-yl-1H-imidazol-5-yl)phenyl]-1,4-dihydroindeno[2,1-b]pyrrole;2-propan-2-yl-5-[4-[4-(2-propan-2-yl-3H-pyrrol-4-yl)phenyl]phenyl]-1H-imidazole;2-propan-2-yl-5-[9-(2-propan-2-yl-3H-pyrrol-4-yl)-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7(12),8,10-hexaenyl]-1H-imidazole.
What is the SMILES notation for 2-propan-2-yl-7-(2-propan-2-yl-1,4-dihydroindeno[2,1-b]pyrrol-6-yl)-1H-benzo[e]indole;6-propan-2-yl-16-(2-propan-2-yl-1H-imidazol-5-yl)-7-azapentacyclo[10.7.0.03,10.04,8.013,18]nonadeca-1,3(10),4(8),6,11,13(18),14,16-octaene;2-propan-2-yl-6-[4-(2-propan-2-yl-1H-imidazol-5-yl)phenyl]-1,4-dihydroindeno[2,1-b]pyrrole;2-propan-2-yl-5-[4-[4-(2-propan-2-yl-3H-pyrrol-4-yl)phenyl]phenyl]-1H-imidazole;2-propan-2-yl-5-[9-(2-propan-2-yl-3H-pyrrol-4-yl)-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7(12),8,10-hexaenyl]-1H-imidazole?
The canonical SMILES for 2-propan-2-yl-7-(2-propan-2-yl-1,4-dihydroindeno[2,1-b]pyrrol-6-yl)-1H-benzo[e]indole;6-propan-2-yl-16-(2-propan-2-yl-1H-imidazol-5-yl)-7-azapentacyclo[10.7.0.03,10.04,8.013,18]nonadeca-1,3(10),4(8),6,11,13(18),14,16-octaene;2-propan-2-yl-6-[4-(2-propan-2-yl-1H-imidazol-5-yl)phenyl]-1,4-dihydroindeno[2,1-b]pyrrole;2-propan-2-yl-5-[4-[4-(2-propan-2-yl-3H-pyrrol-4-yl)phenyl]phenyl]-1H-imidazole;2-propan-2-yl-5-[9-(2-propan-2-yl-3H-pyrrol-4-yl)-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7(12),8,10-hexaenyl]-1H-imidazole is CC(C)C1=NC2=C(C1)c1cc3c(cc1C2)-c1ccc(-c2cnc(C(C)C)[nH]2)cc1C3.CC(C)C1=NC2=C(C1)c1ccc(-c3ccc(-c4cnc(C(C)C)[nH]4)cc3)cc1C2.CC(C)C1=NC2=C(C1)c1ccc(-c3ccc4c5c(ccc4c3)N=C(C(C)C)C5)cc1C2.CC(C)C1=NC=C(c2cc3c4c(c2)Cc2cc(-c5cnc(C(C)C)[nH]5)cc(c2-4)C3)C1.CC(C)C1=NC=C(c2ccc(-c3ccc(-c4cnc(C(C)C)[nH]4)cc3)cc2)C1.
What is the InChIKey of 2-propan-2-yl-7-(2-propan-2-yl-1,4-dihydroindeno[2,1-b]pyrrol-6-yl)-1H-benzo[e]indole;6-propan-2-yl-16-(2-propan-2-yl-1H-imidazol-5-yl)-7-azapentacyclo[10.7.0.03,10.04,8.013,18]nonadeca-1,3(10),4(8),6,11,13(18),14,16-octaene;2-propan-2-yl-6-[4-(2-propan-2-yl-1H-imidazol-5-yl)phenyl]-1,4-dihydroindeno[2,1-b]pyrrole;2-propan-2-yl-5-[4-[4-(2-propan-2-yl-3H-pyrrol-4-yl)phenyl]phenyl]-1H-imidazole;2-propan-2-yl-5-[9-(2-propan-2-yl-3H-pyrrol-4-yl)-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7(12),8,10-hexaenyl]-1H-imidazole?
The InChIKey is ZJWSTUANPLMINU-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H28N2.2C27H27N3.C26H27N3.C25H27N3/c1-16(2)27-14-24-22-8-5-18(11-20(22)7-10-26(24)30-27)19-6-9-23-21(12-19)13-29-25(23)15-28(31-29)17(3)4;1-14(2)23-11-22(12-28-23)16-5-18-9-20-7-17(24-13-29-27(30-24)15(3)4)8-21-10-19(6-16)25(18)26(20)21;1-14(2)24-12-23-22-9-18-8-17-7-16(26-13-28-27(30-26)15(3)4)5-6-20(17)21(18)10-19(22)11-25(23)29-24;1-15(2)23-13-22-21-10-9-19(11-20(21)12-24(22)28-23)17-5-7-18(8-6-17)25-14-27-26(29-25)16(3)4;1-16(2)23-13-22(14-26-23)20-7-5-18(6-8-20)19-9-11-21(12-10-19)24-15-27-25(28-24)17(3)4/h5-12,16-17H,13-15H2,1-4H3;5-8,12-15H,9-11H2,1-4H3,(H,29,30);5-7,9-10,13-15H,8,11-12H2,1-4H3,(H,28,30);5-11,14-16H,12-13H2,1-4H3,(H,27,29);5-12,14-17H,13H2,1-4H3,(H,27,28).
What are the key properties of 2-propan-2-yl-7-(2-propan-2-yl-1,4-dihydroindeno[2,1-b]pyrrol-6-yl)-1H-benzo[e]indole;6-propan-2-yl-16-(2-propan-2-yl-1H-imidazol-5-yl)-7-azapentacyclo[10.7.0.03,10.04,8.013,18]nonadeca-1,3(10),4(8),6,11,13(18),14,16-octaene;2-propan-2-yl-6-[4-(2-propan-2-yl-1H-imidazol-5-yl)phenyl]-1,4-dihydroindeno[2,1-b]pyrrole;2-propan-2-yl-5-[4-[4-(2-propan-2-yl-3H-pyrrol-4-yl)phenyl]phenyl]-1H-imidazole;2-propan-2-yl-5-[9-(2-propan-2-yl-3H-pyrrol-4-yl)-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7(12),8,10-hexaenyl]-1H-imidazole?
2-propan-2-yl-7-(2-propan-2-yl-1,4-dihydroindeno[2,1-b]pyrrol-6-yl)-1H-benzo[e]indole;6-propan-2-yl-16-(2-propan-2-yl-1H-imidazol-5-yl)-7-azapentacyclo[10.7.0.03,10.04,8.013,18]nonadeca-1,3(10),4(8),6,11,13(18),14,16-octaene;2-propan-2-yl-6-[4-(2-propan-2-yl-1H-imidazol-5-yl)phenyl]-1,4-dihydroindeno[2,1-b]pyrrole;2-propan-2-yl-5-[4-[4-(2-propan-2-yl-3H-pyrrol-4-yl)phenyl]phenyl]-1H-imidazole;2-propan-2-yl-5-[9-(2-propan-2-yl-3H-pyrrol-4-yl)-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7(12),8,10-hexaenyl]-1H-imidazole has a molecular weight of 1942.66 g/mol, XLogP of 33.96, 19 rotatable bonds, 4 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yl-7-(2-propan-2-yl-1,4-dihydroindeno[2,1-b]pyrrol-6-yl)-1H-benzo[e]indole;6-propan-2-yl-16-(2-propan-2-yl-1H-imidazol-5-yl)-7-azapentacyclo[10.7.0.03,10.04,8.013,18]nonadeca-1,3(10),4(8),6,11,13(18),14,16-octaene;2-propan-2-yl-6-[4-(2-propan-2-yl-1H-imidazol-5-yl)phenyl]-1,4-dihydroindeno[2,1-b]pyrrole;2-propan-2-yl-5-[4-[4-(2-propan-2-yl-3H-pyrrol-4-yl)phenyl]phenyl]-1H-imidazole;2-propan-2-yl-5-[9-(2-propan-2-yl-3H-pyrrol-4-yl)-3-tetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7(12),8,10-hexaenyl]-1H-imidazole is sourced from PubChem (CID 162140714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).