2-(5-bromo-1H-indol-3-yl)-N-[(5-bromo-1H-indol-3-yl)methyl]-1H-phenanthro[9,10-d]imidazol-5-amine;1-(5-bromo-1H-indol-3-yl)-N-[2-(2-methyl-1H-indol-3-yl)-3H-phenanthro[9,10-d]imidazol-5-yl]methanimine;N-[(5-bromo-1H-indol-3-yl)methyl]-2-(2-methyl-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazol-5-amine;5,10-dibromo-2-(5-bromo-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazole;molecular hydrogen

C121H81Br7N18 — CID 157131553

About 2-(5-bromo-1H-indol-3-yl)-N-[(5-bromo-1H-indol-3-yl)methyl]-1H-phenanthro[9,10-d]imidazol-5-amine;1-(5-bromo-1H-indol-3-yl)-N-[2-(2-methyl-1H-indol-3-yl)-3H-phenanthro[9,10-d]imidazol-5-yl]methanimine;N-[(5-bromo-1H-indol-3-yl)methyl]-2-(2-methyl-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazol-5-amine;5,10-dibromo-2-(5-bromo-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazole;molecular hydrogen

2-(5-bromo-1H-indol-3-yl)-N-[(5-bromo-1H-indol-3-yl)methyl]-1H-phenanthro[9,10-d]imidazol-5-amine;1-(5-bromo-1H-indol-3-yl)-N-[2-(2-methyl-1H-indol-3-yl)-3H-phenanthro[9,10-d]imidazol-5-yl]methanimine;N-[(5-bromo-1H-indol-3-yl)methyl]-2-(2-methyl-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazol-5-amine;5,10-dibromo-2-(5-bromo-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazole;molecular hydrogen (PubChem CID 157131553) has the molecular formula C121H81Br7N18 and a molecular weight of 2346.43 g/mol. Its IUPAC name is 2-(5-bromo-1H-indol-3-yl)-N-[(5-bromo-1H-indol-3-yl)methyl]-1H-phenanthro[9,10-d]imidazol-5-amine;1-(5-bromo-1H-indol-3-yl)-N-[2-(2-methyl-1H-indol-3-yl)-3H-phenanthro[9,10-d]imidazol-5-yl]methanimine;N-[(5-bromo-1H-indol-3-yl)methyl]-2-(2-methyl-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazol-5-amine;5,10-dibromo-2-(5-bromo-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazole;molecular hydrogen.

Molecular Properties

• Compound Name: 2-(5-bromo-1H-indol-3-yl)-N-[(5-bromo-1H-indol-3-yl)methyl]-1H-phenanthro[9,10-d]imidazol-5-amine;1-(5-bromo-1H-indol-3-yl)-N-[2-(2-methyl-1H-indol-3-yl)-3H-phenanthro[9,10-d]imidazol-5-yl]methanimine;N-[(5-bromo-1H-indol-3-yl)methyl]-2-(2-methyl-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazol-5-amine;5,10-dibromo-2-(5-bromo-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazole;molecular hydrogen
• PubChem CID: 157131553
• Molecular Formula: C121H81Br7N18
• Molecular Weight: 2346.43 g/mol
• Exact Mass: 2338.12
• IUPAC Name: 2-(5-bromo-1H-indol-3-yl)-N-[(5-bromo-1H-indol-3-yl)methyl]-1H-phenanthro[9,10-d]imidazol-5-amine;1-(5-bromo-1H-indol-3-yl)-N-[2-(2-methyl-1H-indol-3-yl)-3H-phenanthro[9,10-d]imidazol-5-yl]methanimine;N-[(5-bromo-1H-indol-3-yl)methyl]-2-(2-methyl-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazol-5-amine;5,10-dibromo-2-(5-bromo-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazole;molecular hydrogen
• SMILES: Brc1ccc2[nH]cc(-c3nc4c5cc(Br)ccc5c5ccc(Br)cc5c4[nH]3)c2c1.Brc1ccc2[nH]cc(CNc3ccc4c5ccccc5c5[nH]c(-c6c[nH]c7ccc(Br)cc67)nc5c4c3)c2c1.Cc1[nH]c2ccccc2c1-c1nc2c3cc(NCc4c[nH]c5ccc(Br)cc45)ccc3c3ccccc3c2[nH]1.Cc1[nH]c2ccccc2c1-c1nc2c3ccccc3c3ccc(/N=C/c4c[nH]c5ccc(Br)cc45)cc3c2[nH]1.[H][H]
• InChI: InChI=1S/C33H24BrN5.C33H22BrN5.C32H21Br2N5.C23H12Br3N3.H2/c2*1-18-30(25-8-4-5-9-29(25)37-18)33-38-31-24-7-3-2-6-22(24)23-12-11-21(15-27(23)32(31)39-33)35-16-19-17-36-28-13-10-20(34)14-26(19)28;33-18-5-9-28-24(11-18)17(15-36-28)14-35-20-7-8-22-21-3-1-2-4-23(21)30-31(26(22)13-20)39-32(38-30)27-16-37-29-10-6-19(34)12-25(27)29;24-11-1-4-14-15-5-2-12(25)9-18(15)22-21(17(14)8-11)28-23(29-22)19-10-27-20-6-3-13(26)7-16(19)20;/h2-15,17,35-37H,16H2,1H3,(H,38,39);2-17,36-37H,1H3,(H,38,39);1-13,15-16,35-37H,14H2,(H,38,39);1-10,27H,(H,28,29);1H/b;35-16+
• InChIKey: AJDFEQJQSUJDPE-POOHDRPTSA-N
• XLogP: 36.69
• TPSA: 261.67 Ų
• H-Bond Donors: 13
• H-Bond Acceptors: 7
• Rotatable Bonds: 12
• Heavy Atoms: 146
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2346.43
LogP ≤ 5	36.69
H-Bond Donors ≤ 5	13
H-Bond Acceptors ≤ 10	7

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-(5-bromo-1H-indol-3-yl)-N-[(5-bromo-1H-indol-3-yl)methyl]-1H-phenanthro[9,10-d]imidazol-5-amine;1-(5-bromo-1H-indol-3-yl)-N-[2-(2-methyl-1H-indol-3-yl)-3H-phenanthro[9,10-d]imidazol-5-yl]methanimine;N-[(5-bromo-1H-indol-3-yl)methyl]-2-(2-methyl-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazol-5-amine;5,10-dibromo-2-(5-bromo-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazole;molecular hydrogen?

The IUPAC name of 2-(5-bromo-1H-indol-3-yl)-N-[(5-bromo-1H-indol-3-yl)methyl]-1H-phenanthro[9,10-d]imidazol-5-amine;1-(5-bromo-1H-indol-3-yl)-N-[2-(2-methyl-1H-indol-3-yl)-3H-phenanthro[9,10-d]imidazol-5-yl]methanimine;N-[(5-bromo-1H-indol-3-yl)methyl]-2-(2-methyl-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazol-5-amine;5,10-dibromo-2-(5-bromo-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazole;molecular hydrogen (CID 157131553) is 2-(5-bromo-1H-indol-3-yl)-N-[(5-bromo-1H-indol-3-yl)methyl]-1H-phenanthro[9,10-d]imidazol-5-amine;1-(5-bromo-1H-indol-3-yl)-N-[2-(2-methyl-1H-indol-3-yl)-3H-phenanthro[9,10-d]imidazol-5-yl]methanimine;N-[(5-bromo-1H-indol-3-yl)methyl]-2-(2-methyl-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazol-5-amine;5,10-dibromo-2-(5-bromo-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazole;molecular hydrogen.

What is the SMILES notation for 2-(5-bromo-1H-indol-3-yl)-N-[(5-bromo-1H-indol-3-yl)methyl]-1H-phenanthro[9,10-d]imidazol-5-amine;1-(5-bromo-1H-indol-3-yl)-N-[2-(2-methyl-1H-indol-3-yl)-3H-phenanthro[9,10-d]imidazol-5-yl]methanimine;N-[(5-bromo-1H-indol-3-yl)methyl]-2-(2-methyl-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazol-5-amine;5,10-dibromo-2-(5-bromo-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazole;molecular hydrogen?

The canonical SMILES for 2-(5-bromo-1H-indol-3-yl)-N-[(5-bromo-1H-indol-3-yl)methyl]-1H-phenanthro[9,10-d]imidazol-5-amine;1-(5-bromo-1H-indol-3-yl)-N-[2-(2-methyl-1H-indol-3-yl)-3H-phenanthro[9,10-d]imidazol-5-yl]methanimine;N-[(5-bromo-1H-indol-3-yl)methyl]-2-(2-methyl-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazol-5-amine;5,10-dibromo-2-(5-bromo-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazole;molecular hydrogen is Brc1ccc2[nH]cc(-c3nc4c5cc(Br)ccc5c5ccc(Br)cc5c4[nH]3)c2c1.Brc1ccc2[nH]cc(CNc3ccc4c5ccccc5c5[nH]c(-c6c[nH]c7ccc(Br)cc67)nc5c4c3)c2c1.Cc1[nH]c2ccccc2c1-c1nc2c3cc(NCc4c[nH]c5ccc(Br)cc45)ccc3c3ccccc3c2[nH]1.Cc1[nH]c2ccccc2c1-c1nc2c3ccccc3c3ccc(/N=C/c4c[nH]c5ccc(Br)cc45)cc3c2[nH]1.[H][H].

What is the InChIKey of 2-(5-bromo-1H-indol-3-yl)-N-[(5-bromo-1H-indol-3-yl)methyl]-1H-phenanthro[9,10-d]imidazol-5-amine;1-(5-bromo-1H-indol-3-yl)-N-[2-(2-methyl-1H-indol-3-yl)-3H-phenanthro[9,10-d]imidazol-5-yl]methanimine;N-[(5-bromo-1H-indol-3-yl)methyl]-2-(2-methyl-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazol-5-amine;5,10-dibromo-2-(5-bromo-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazole;molecular hydrogen?

The InChIKey is AJDFEQJQSUJDPE-POOHDRPTSA-N. The full InChI is InChI=1S/C33H24BrN5.C33H22BrN5.C32H21Br2N5.C23H12Br3N3.H2/c2*1-18-30(25-8-4-5-9-29(25)37-18)33-38-31-24-7-3-2-6-22(24)23-12-11-21(15-27(23)32(31)39-33)35-16-19-17-36-28-13-10-20(34)14-26(19)28;33-18-5-9-28-24(11-18)17(15-36-28)14-35-20-7-8-22-21-3-1-2-4-23(21)30-31(26(22)13-20)39-32(38-30)27-16-37-29-10-6-19(34)12-25(27)29;24-11-1-4-14-15-5-2-12(25)9-18(15)22-21(17(14)8-11)28-23(29-22)19-10-27-20-6-3-13(26)7-16(19)20;/h2-15,17,35-37H,16H2,1H3,(H,38,39);2-17,36-37H,1H3,(H,38,39);1-13,15-16,35-37H,14H2,(H,38,39);1-10,27H,(H,28,29);1H/b;35-16+;;;.

What are the key properties of 2-(5-bromo-1H-indol-3-yl)-N-[(5-bromo-1H-indol-3-yl)methyl]-1H-phenanthro[9,10-d]imidazol-5-amine;1-(5-bromo-1H-indol-3-yl)-N-[2-(2-methyl-1H-indol-3-yl)-3H-phenanthro[9,10-d]imidazol-5-yl]methanimine;N-[(5-bromo-1H-indol-3-yl)methyl]-2-(2-methyl-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazol-5-amine;5,10-dibromo-2-(5-bromo-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazole;molecular hydrogen?

2-(5-bromo-1H-indol-3-yl)-N-[(5-bromo-1H-indol-3-yl)methyl]-1H-phenanthro[9,10-d]imidazol-5-amine;1-(5-bromo-1H-indol-3-yl)-N-[2-(2-methyl-1H-indol-3-yl)-3H-phenanthro[9,10-d]imidazol-5-yl]methanimine;N-[(5-bromo-1H-indol-3-yl)methyl]-2-(2-methyl-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazol-5-amine;5,10-dibromo-2-(5-bromo-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazole;molecular hydrogen has a molecular weight of 2346.43 g/mol, XLogP of 36.69, 12 rotatable bonds, 13 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(5-bromo-1H-indol-3-yl)-N-[(5-bromo-1H-indol-3-yl)methyl]-1H-phenanthro[9,10-d]imidazol-5-amine;1-(5-bromo-1H-indol-3-yl)-N-[2-(2-methyl-1H-indol-3-yl)-3H-phenanthro[9,10-d]imidazol-5-yl]methanimine;N-[(5-bromo-1H-indol-3-yl)methyl]-2-(2-methyl-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazol-5-amine;5,10-dibromo-2-(5-bromo-1H-indol-3-yl)-1H-phenanthro[9,10-d]imidazole;molecular hydrogen is sourced from PubChem (CID 157131553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).