5-[4-[(4-pyrido[3,2-b]indol-5-ylphenyl)methyl]phenyl]pyrido[3,2-b]indole;9-[4-[(4-pyrido[3,4-b]indol-9-ylphenyl)methyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]propan-2-yl]phenyl]pyrido[4,3-b]indole;5-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]pyrido[4,3-b]indole;8-[4-[4-[[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]methyl]phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;8-[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene

C230H164N28 — CID 157362943

IUPAC5-[4-[(4-pyrido[3,2-b]indol-5-ylphenyl)methyl]phenyl]pyrido[3,2-b]indole;9-[4-[(4-pyrido[3,4-b]indol-9-ylphenyl)methyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]propan-2-yl]phenyl]pyrido[4,3-b]indole;5-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]pyrido[4,3-b]indole;8-[4-[4-[[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]methyl]phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;8-[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
SMILESCC(C)(c1ccc(-n2c3ccccc3c3cnccc32)cc1)c1ccc(-n2c3ccccc3c3cnccc32)cc1.CC(C)(c1ccc(-n2c3ccccc3c3cnccc32)cc1)c1ccc(C(C)(C)c2ccc(-n3c4ccccc4c4cnccc43)cc2)cc1.c1cc2c(cn1)c1cnccc1n2-c1ccc(-c2ccc(-n3c4ccncc4c4cnccc43)cc2)cc1.c1cc2c(cn1)c1cnccc1n2-c1ccc(-c2ccc(Cc3ccc(-c4ccc(-n5c6ccncc6c6cnccc65)cc4)cc3)cc2)cc1.c1ccc2c(c1)c1ccncc1n2-c1ccc(Cc2ccc(-n3c4ccccc4c4ccncc43)cc2)cc1.c1ccc2c(c1)c1ncccc1n2-c1ccc(Cc2ccc(-n3c4ccccc4c4ncccc43)cc2)cc1
InChIInChI=1S/C46H38N4.C45H30N6.C37H28N4.2C35H24N4.C32H20N6/c1-45(2,33-17-21-35(22-18-33)49-41-11-7-5-9-37(41)39-29-47-27-25-43(39)49)31-13-15-32(16-14-31)46(3,4)34-19-23-36(24-20-34)50-42-12-8-6-10-38(42)40-30-48-28-26-44(40)50;1-5-32(34-9-13-36(14-10-34)50-42-17-21-46-26-38(42)39-27-47-22-18-43(39)50)6-2-30(1)25-31-3-7-33(8-4-31)35-11-15-37(16-12-35)51-44-19-23-48-28-40(44)41-29-49-24-20-45(41)51;1-37(2,25-11-15-27(16-12-25)40-33-9-5-3-7-29(33)31-23-38-21-19-35(31)40)26-13-17-28(18-14-26)41-34-10-6-4-8-30(34)32-24-39-22-20-36(32)41;1-3-9-30-28(7-1)34-32(11-5-21-36-34)38(30)26-17-13-24(14-18-26)23-25-15-19-27(20-16-25)39-31-10-4-2-8-29(31)35-33(39)12-6-22-37-35;1-3-7-32-28(5-1)30-17-19-36-22-34(30)38(32)26-13-9-24(10-14-26)21-25-11-15-27(16-12-25)39-33-8-4-2-6-29(33)31-18-20-37-23-35(31)39;1-5-23(37-29-9-13-33-17-25(29)26-18-34-14-10-30(26)37)6-2-21(1)22-3-7-24(8-4-22)38-31-11-15-35-19-27(31)28-20-36-16-12-32(28)38/h5-30H,1-4H3;1-24,26-29H,25H2;3-24H,1-2H3;1-22H,23H2;1-20,22-23H,21H2;1-20H
InChIKeyBIVUKJMDNGYCRC-UHFFFAOYSA-N
MW3320.04 g/mol
LogP54.36
Rot. Bonds27

About 5-[4-[(4-pyrido[3,2-b]indol-5-ylphenyl)methyl]phenyl]pyrido[3,2-b]indole;9-[4-[(4-pyrido[3,4-b]indol-9-ylphenyl)methyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]propan-2-yl]phenyl]pyrido[4,3-b]indole;5-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]pyrido[4,3-b]indole;8-[4-[4-[[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]methyl]phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;8-[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene

5-[4-[(4-pyrido[3,2-b]indol-5-ylphenyl)methyl]phenyl]pyrido[3,2-b]indole;9-[4-[(4-pyrido[3,4-b]indol-9-ylphenyl)methyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]propan-2-yl]phenyl]pyrido[4,3-b]indole;5-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]pyrido[4,3-b]indole;8-[4-[4-[[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]methyl]phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;8-[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene (PubChem CID 157362943) has the molecular formula C230H164N28 and a molecular weight of 3320.04 g/mol. Its IUPAC name is 5-[4-[(4-pyrido[3,2-b]indol-5-ylphenyl)methyl]phenyl]pyrido[3,2-b]indole;9-[4-[(4-pyrido[3,4-b]indol-9-ylphenyl)methyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]propan-2-yl]phenyl]pyrido[4,3-b]indole;5-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]pyrido[4,3-b]indole;8-[4-[4-[[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]methyl]phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;8-[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene.

Molecular Properties

Compound Name5-[4-[(4-pyrido[3,2-b]indol-5-ylphenyl)methyl]phenyl]pyrido[3,2-b]indole;9-[4-[(4-pyrido[3,4-b]indol-9-ylphenyl)methyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]propan-2-yl]phenyl]pyrido[4,3-b]indole;5-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]pyrido[4,3-b]indole;8-[4-[4-[[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]methyl]phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;8-[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
PubChem CID157362943
Molecular FormulaC230H164N28
Molecular Weight3320.04 g/mol
Exact Mass3317.37
IUPAC Name5-[4-[(4-pyrido[3,2-b]indol-5-ylphenyl)methyl]phenyl]pyrido[3,2-b]indole;9-[4-[(4-pyrido[3,4-b]indol-9-ylphenyl)methyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]propan-2-yl]phenyl]pyrido[4,3-b]indole;5-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]pyrido[4,3-b]indole;8-[4-[4-[[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]methyl]phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;8-[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
SMILESCC(C)(c1ccc(-n2c3ccccc3c3cnccc32)cc1)c1ccc(-n2c3ccccc3c3cnccc32)cc1.CC(C)(c1ccc(-n2c3ccccc3c3cnccc32)cc1)c1ccc(C(C)(C)c2ccc(-n3c4ccccc4c4cnccc43)cc2)cc1.c1cc2c(cn1)c1cnccc1n2-c1ccc(-c2ccc(-n3c4ccncc4c4cnccc43)cc2)cc1.c1cc2c(cn1)c1cnccc1n2-c1ccc(-c2ccc(Cc3ccc(-c4ccc(-n5c6ccncc6c6cnccc65)cc4)cc3)cc2)cc1.c1ccc2c(c1)c1ccncc1n2-c1ccc(Cc2ccc(-n3c4ccccc4c4ccncc43)cc2)cc1.c1ccc2c(c1)c1ncccc1n2-c1ccc(Cc2ccc(-n3c4ccccc4c4ncccc43)cc2)cc1
InChIInChI=1S/C46H38N4.C45H30N6.C37H28N4.2C35H24N4.C32H20N6/c1-45(2,33-17-21-35(22-18-33)49-41-11-7-5-9-37(41)39-29-47-27-25-43(39)49)31-13-15-32(16-14-31)46(3,4)34-19-23-36(24-20-34)50-42-12-8-6-10-38(42)40-30-48-28-26-44(40)50;1-5-32(34-9-13-36(14-10-34)50-42-17-21-46-26-38(42)39-27-47-22-18-43(39)50)6-2-30(1)25-31-3-7-33(8-4-31)35-11-15-37(16-12-35)51-44-19-23-48-28-40(44)41-29-49-24-20-45(41)51;1-37(2,25-11-15-27(16-12-25)40-33-9-5-3-7-29(33)31-23-38-21-19-35(31)40)26-13-17-28(18-14-26)41-34-10-6-4-8-30(34)32-24-39-22-20-36(32)41;1-3-9-30-28(7-1)34-32(11-5-21-36-34)38(30)26-17-13-24(14-18-26)23-25-15-19-27(20-16-25)39-31-10-4-2-8-29(31)35-33(39)12-6-22-37-35;1-3-7-32-28(5-1)30-17-19-36-22-34(30)38(32)26-13-9-24(10-14-26)21-25-11-15-27(16-12-25)39-33-8-4-2-6-29(33)31-18-20-37-23-35(31)39;1-5-23(37-29-9-13-33-17-25(29)26-18-34-14-10-30(26)37)6-2-21(1)22-3-7-24(8-4-22)38-31-11-15-35-19-27(31)28-20-36-16-12-32(28)38/h5-30H,1-4H3;1-24,26-29H,25H2;3-24H,1-2H3;1-22H,23H2;1-20,22-23H,21H2;1-20H
InChIKeyBIVUKJMDNGYCRC-UHFFFAOYSA-N
XLogP54.36
TPSA265.40 Ų
H-Bond Donors
H-Bond Acceptors28
Rotatable Bonds27
Heavy Atoms258
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003320.04
LogP ≤ 554.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1028

Analyze 5-[4-[(4-pyrido[3,2-b]indol-5-ylphenyl)methyl]phenyl]pyrido[3,2-b]indole;9-[4-[(4-pyrido[3,4-b]indol-9-ylphenyl)methyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]propan-2-yl]phenyl]pyrido[4,3-b]indole;5-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]pyrido[4,3-b]indole;8-[4-[4-[[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]methyl]phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;8-[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene with MolForge

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Related Compounds

1-Pyridin-3-yl-9-[6-(1-pyridin-3-ylpyrido[3,4-b]indol-9-yl)hexyl]pyrido[3,4-b]indole
CID 71539945
9-[[1-[[4-[4-[[4-(Carbazol-9-ylmethyl)triazol-1-yl]methyl]phenyl]phenyl]methyl]triazol-4-yl]methyl]carbazole
CID 155544405
9-[[1-[[4-[[4-(Carbazol-9-ylmethyl)triazol-1-yl]methyl]phenyl]methyl]triazol-4-yl]methyl]carbazole
CID 155551077
1-Pyridin-3-yl-9-[4-(1-pyridin-3-ylpyrido[3,4-b]indol-9-yl)butyl]pyrido[3,4-b]indole
CID 71539896
9-Butyl-3-[[4-[(9-butylpyrido[3,4-b]indol-3-yl)methyl]piperazin-1-yl]methyl]pyrido[3,4-b]indole
CID 127029326
9-(3-Phenylpropyl)-3-[[4-[[9-(3-phenylpropyl)pyrido[3,4-b]indol-3-yl]methyl]piperazin-1-yl]methyl]pyrido[3,4-b]indole
CID 127029591
Bis(1,10-phenanthroline);quinoxalino[2,3-f][1,10]phenanthroline;ruthenium
CID 57339425
1-[(1-Benzyltriazol-4-yl)methyl]-3-[[1-[(1-benzyltriazol-4-yl)methyl]indol-3-yl]-phenylmethyl]indole
CID 44511354
1-[(1-Benzyltriazol-4-yl)methyl]-3-[[1-[(1-benzyltriazol-4-yl)methyl]-2-methylindol-3-yl]-phenylmethyl]-2-methylindole
CID 44583480
Ru(II)(phen)2(phen-cyclam-Ni(II)
CID 16683885
Ru(II)(phen)2(phen-cyclam-Cu(II)
CID 16683886
Ru(II)(phen)2(phen-cyclam-Fe(III))
CID 16683887

Frequently Asked Questions

What is the IUPAC name of 5-[4-[(4-pyrido[3,2-b]indol-5-ylphenyl)methyl]phenyl]pyrido[3,2-b]indole;9-[4-[(4-pyrido[3,4-b]indol-9-ylphenyl)methyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]propan-2-yl]phenyl]pyrido[4,3-b]indole;5-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]pyrido[4,3-b]indole;8-[4-[4-[[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]methyl]phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;8-[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene?
The IUPAC name of 5-[4-[(4-pyrido[3,2-b]indol-5-ylphenyl)methyl]phenyl]pyrido[3,2-b]indole;9-[4-[(4-pyrido[3,4-b]indol-9-ylphenyl)methyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]propan-2-yl]phenyl]pyrido[4,3-b]indole;5-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]pyrido[4,3-b]indole;8-[4-[4-[[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]methyl]phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;8-[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene (CID 157362943) is 5-[4-[(4-pyrido[3,2-b]indol-5-ylphenyl)methyl]phenyl]pyrido[3,2-b]indole;9-[4-[(4-pyrido[3,4-b]indol-9-ylphenyl)methyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]propan-2-yl]phenyl]pyrido[4,3-b]indole;5-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]pyrido[4,3-b]indole;8-[4-[4-[[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]methyl]phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;8-[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene.
What is the SMILES notation for 5-[4-[(4-pyrido[3,2-b]indol-5-ylphenyl)methyl]phenyl]pyrido[3,2-b]indole;9-[4-[(4-pyrido[3,4-b]indol-9-ylphenyl)methyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]propan-2-yl]phenyl]pyrido[4,3-b]indole;5-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]pyrido[4,3-b]indole;8-[4-[4-[[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]methyl]phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;8-[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene?
The canonical SMILES for 5-[4-[(4-pyrido[3,2-b]indol-5-ylphenyl)methyl]phenyl]pyrido[3,2-b]indole;9-[4-[(4-pyrido[3,4-b]indol-9-ylphenyl)methyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]propan-2-yl]phenyl]pyrido[4,3-b]indole;5-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]pyrido[4,3-b]indole;8-[4-[4-[[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]methyl]phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;8-[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene is CC(C)(c1ccc(-n2c3ccccc3c3cnccc32)cc1)c1ccc(-n2c3ccccc3c3cnccc32)cc1.CC(C)(c1ccc(-n2c3ccccc3c3cnccc32)cc1)c1ccc(C(C)(C)c2ccc(-n3c4ccccc4c4cnccc43)cc2)cc1.c1cc2c(cn1)c1cnccc1n2-c1ccc(-c2ccc(-n3c4ccncc4c4cnccc43)cc2)cc1.c1cc2c(cn1)c1cnccc1n2-c1ccc(-c2ccc(Cc3ccc(-c4ccc(-n5c6ccncc6c6cnccc65)cc4)cc3)cc2)cc1.c1ccc2c(c1)c1ccncc1n2-c1ccc(Cc2ccc(-n3c4ccccc4c4ccncc43)cc2)cc1.c1ccc2c(c1)c1ncccc1n2-c1ccc(Cc2ccc(-n3c4ccccc4c4ncccc43)cc2)cc1.
What is the InChIKey of 5-[4-[(4-pyrido[3,2-b]indol-5-ylphenyl)methyl]phenyl]pyrido[3,2-b]indole;9-[4-[(4-pyrido[3,4-b]indol-9-ylphenyl)methyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]propan-2-yl]phenyl]pyrido[4,3-b]indole;5-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]pyrido[4,3-b]indole;8-[4-[4-[[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]methyl]phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;8-[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene?
The InChIKey is BIVUKJMDNGYCRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H38N4.C45H30N6.C37H28N4.2C35H24N4.C32H20N6/c1-45(2,33-17-21-35(22-18-33)49-41-11-7-5-9-37(41)39-29-47-27-25-43(39)49)31-13-15-32(16-14-31)46(3,4)34-19-23-36(24-20-34)50-42-12-8-6-10-38(42)40-30-48-28-26-44(40)50;1-5-32(34-9-13-36(14-10-34)50-42-17-21-46-26-38(42)39-27-47-22-18-43(39)50)6-2-30(1)25-31-3-7-33(8-4-31)35-11-15-37(16-12-35)51-44-19-23-48-28-40(44)41-29-49-24-20-45(41)51;1-37(2,25-11-15-27(16-12-25)40-33-9-5-3-7-29(33)31-23-38-21-19-35(31)40)26-13-17-28(18-14-26)41-34-10-6-4-8-30(34)32-24-39-22-20-36(32)41;1-3-9-30-28(7-1)34-32(11-5-21-36-34)38(30)26-17-13-24(14-18-26)23-25-15-19-27(20-16-25)39-31-10-4-2-8-29(31)35-33(39)12-6-22-37-35;1-3-7-32-28(5-1)30-17-19-36-22-34(30)38(32)26-13-9-24(10-14-26)21-25-11-15-27(16-12-25)39-33-8-4-2-6-29(33)31-18-20-37-23-35(31)39;1-5-23(37-29-9-13-33-17-25(29)26-18-34-14-10-30(26)37)6-2-21(1)22-3-7-24(8-4-22)38-31-11-15-35-19-27(31)28-20-36-16-12-32(28)38/h5-30H,1-4H3;1-24,26-29H,25H2;3-24H,1-2H3;1-22H,23H2;1-20,22-23H,21H2;1-20H.
What are the key properties of 5-[4-[(4-pyrido[3,2-b]indol-5-ylphenyl)methyl]phenyl]pyrido[3,2-b]indole;9-[4-[(4-pyrido[3,4-b]indol-9-ylphenyl)methyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]propan-2-yl]phenyl]pyrido[4,3-b]indole;5-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]pyrido[4,3-b]indole;8-[4-[4-[[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]methyl]phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;8-[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene?
5-[4-[(4-pyrido[3,2-b]indol-5-ylphenyl)methyl]phenyl]pyrido[3,2-b]indole;9-[4-[(4-pyrido[3,4-b]indol-9-ylphenyl)methyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]propan-2-yl]phenyl]pyrido[4,3-b]indole;5-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]pyrido[4,3-b]indole;8-[4-[4-[[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]methyl]phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;8-[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene has a molecular weight of 3320.04 g/mol, XLogP of 54.36, 27 rotatable bonds, 0 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-[(4-pyrido[3,2-b]indol-5-ylphenyl)methyl]phenyl]pyrido[3,2-b]indole;9-[4-[(4-pyrido[3,4-b]indol-9-ylphenyl)methyl]phenyl]pyrido[3,4-b]indole;5-[4-[2-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]propan-2-yl]phenyl]pyrido[4,3-b]indole;5-[4-[2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]pyrido[4,3-b]indole;8-[4-[4-[[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]methyl]phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;8-[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene is sourced from PubChem (CID 157362943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).