5-[3-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole;7,7-dimethyl-5-[3-(9-phenylcarbazol-3-yl)phenyl]indeno[2,1-b]carbazole;11-phenyl-12-[3-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole

C153H106N8 — CID 160662276

IUPAC5-[3-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole;7,7-dimethyl-5-[3-(9-phenylcarbazol-3-yl)phenyl]indeno[2,1-b]carbazole;11-phenyl-12-[3-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole
SMILESCC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4cccc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)c4)c3cc21.CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4cccc(-c5cccc(-n6c7ccccc7c7cc8c(cc76)C(C)(C)c6ccccc6-8)c5)c4)c3cc21.c1ccc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5cccc(-n6c7ccccc7c7ccc8c9ccccc9n(-c9ccccc9)c8c76)c5)c4c32)cc1
InChIInChI=1S/C54H34N4.C54H40N2.C45H32N2/c1-3-16-35(17-4-1)55-47-26-11-7-22-39(47)43-30-32-45-41-24-9-13-28-49(41)57(53(45)51(43)55)37-20-15-21-38(34-37)58-50-29-14-10-25-42(50)46-33-31-44-40-23-8-12-27-48(40)56(52(44)54(46)58)36-18-5-2-6-19-36;1-53(2)45-23-9-5-19-37(45)41-29-43-39-21-7-11-25-49(39)55(51(43)31-47(41)53)35-17-13-15-33(27-35)34-16-14-18-36(28-34)56-50-26-12-8-22-40(50)44-30-42-38-20-6-10-24-46(38)54(3,4)48(42)32-52(44)56;1-45(2)39-20-9-6-17-33(39)36-27-38-35-19-8-11-22-42(35)47(44(38)28-40(36)45)32-16-12-13-29(25-32)30-23-24-43-37(26-30)34-18-7-10-21-41(34)46(43)31-14-4-3-5-15-31/h1-34H;5-32H,1-4H3;3-28H,1-2H3
InChIKeyRLVHMKFFRIHHEQ-UHFFFAOYSA-N
MW2056.59 g/mol
LogP40.09
Rot. Bonds10

About 5-[3-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole;7,7-dimethyl-5-[3-(9-phenylcarbazol-3-yl)phenyl]indeno[2,1-b]carbazole;11-phenyl-12-[3-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole

5-[3-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole;7,7-dimethyl-5-[3-(9-phenylcarbazol-3-yl)phenyl]indeno[2,1-b]carbazole;11-phenyl-12-[3-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole (PubChem CID 160662276) has the molecular formula C153H106N8 and a molecular weight of 2056.59 g/mol. Its IUPAC name is 5-[3-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole;7,7-dimethyl-5-[3-(9-phenylcarbazol-3-yl)phenyl]indeno[2,1-b]carbazole;11-phenyl-12-[3-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole.

Molecular Properties

Compound Name5-[3-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole;7,7-dimethyl-5-[3-(9-phenylcarbazol-3-yl)phenyl]indeno[2,1-b]carbazole;11-phenyl-12-[3-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole
PubChem CID160662276
Molecular FormulaC153H106N8
Molecular Weight2056.59 g/mol
Exact Mass2054.85
IUPAC Name5-[3-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole;7,7-dimethyl-5-[3-(9-phenylcarbazol-3-yl)phenyl]indeno[2,1-b]carbazole;11-phenyl-12-[3-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole
SMILESCC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4cccc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)c4)c3cc21.CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4cccc(-c5cccc(-n6c7ccccc7c7cc8c(cc76)C(C)(C)c6ccccc6-8)c5)c4)c3cc21.c1ccc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5cccc(-n6c7ccccc7c7ccc8c9ccccc9n(-c9ccccc9)c8c76)c5)c4c32)cc1
InChIInChI=1S/C54H34N4.C54H40N2.C45H32N2/c1-3-16-35(17-4-1)55-47-26-11-7-22-39(47)43-30-32-45-41-24-9-13-28-49(41)57(53(45)51(43)55)37-20-15-21-38(34-37)58-50-29-14-10-25-42(50)46-33-31-44-40-23-8-12-27-48(40)56(52(44)54(46)58)36-18-5-2-6-19-36;1-53(2)45-23-9-5-19-37(45)41-29-43-39-21-7-11-25-49(39)55(51(43)31-47(41)53)35-17-13-15-33(27-35)34-16-14-18-36(28-34)56-50-26-12-8-22-40(50)44-30-42-38-20-6-10-24-46(38)54(3,4)48(42)32-52(44)56;1-45(2)39-20-9-6-17-33(39)36-27-38-35-19-8-11-22-42(35)47(44(38)28-40(36)45)32-16-12-13-29(25-32)30-23-24-43-37(26-30)34-18-7-10-21-41(34)46(43)31-14-4-3-5-15-31/h1-34H;5-32H,1-4H3;3-28H,1-2H3
InChIKeyRLVHMKFFRIHHEQ-UHFFFAOYSA-N
XLogP40.09
TPSA39.44 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds10
Heavy Atoms161
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002056.59
LogP ≤ 540.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 5-[3-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole;7,7-dimethyl-5-[3-(9-phenylcarbazol-3-yl)phenyl]indeno[2,1-b]carbazole;11-phenyl-12-[3-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-[3-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole;7,7-dimethyl-5-[3-(9-phenylcarbazol-3-yl)phenyl]indeno[2,1-b]carbazole;11-phenyl-12-[3-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole?
The IUPAC name of 5-[3-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole;7,7-dimethyl-5-[3-(9-phenylcarbazol-3-yl)phenyl]indeno[2,1-b]carbazole;11-phenyl-12-[3-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole (CID 160662276) is 5-[3-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole;7,7-dimethyl-5-[3-(9-phenylcarbazol-3-yl)phenyl]indeno[2,1-b]carbazole;11-phenyl-12-[3-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole.
What is the SMILES notation for 5-[3-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole;7,7-dimethyl-5-[3-(9-phenylcarbazol-3-yl)phenyl]indeno[2,1-b]carbazole;11-phenyl-12-[3-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole?
The canonical SMILES for 5-[3-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole;7,7-dimethyl-5-[3-(9-phenylcarbazol-3-yl)phenyl]indeno[2,1-b]carbazole;11-phenyl-12-[3-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole is CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4cccc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)c4)c3cc21.CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4cccc(-c5cccc(-n6c7ccccc7c7cc8c(cc76)C(C)(C)c6ccccc6-8)c5)c4)c3cc21.c1ccc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5cccc(-n6c7ccccc7c7ccc8c9ccccc9n(-c9ccccc9)c8c76)c5)c4c32)cc1.
What is the InChIKey of 5-[3-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole;7,7-dimethyl-5-[3-(9-phenylcarbazol-3-yl)phenyl]indeno[2,1-b]carbazole;11-phenyl-12-[3-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole?
The InChIKey is RLVHMKFFRIHHEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H34N4.C54H40N2.C45H32N2/c1-3-16-35(17-4-1)55-47-26-11-7-22-39(47)43-30-32-45-41-24-9-13-28-49(41)57(53(45)51(43)55)37-20-15-21-38(34-37)58-50-29-14-10-25-42(50)46-33-31-44-40-23-8-12-27-48(40)56(52(44)54(46)58)36-18-5-2-6-19-36;1-53(2)45-23-9-5-19-37(45)41-29-43-39-21-7-11-25-49(39)55(51(43)31-47(41)53)35-17-13-15-33(27-35)34-16-14-18-36(28-34)56-50-26-12-8-22-40(50)44-30-42-38-20-6-10-24-46(38)54(3,4)48(42)32-52(44)56;1-45(2)39-20-9-6-17-33(39)36-27-38-35-19-8-11-22-42(35)47(44(38)28-40(36)45)32-16-12-13-29(25-32)30-23-24-43-37(26-30)34-18-7-10-21-41(34)46(43)31-14-4-3-5-15-31/h1-34H;5-32H,1-4H3;3-28H,1-2H3.
What are the key properties of 5-[3-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole;7,7-dimethyl-5-[3-(9-phenylcarbazol-3-yl)phenyl]indeno[2,1-b]carbazole;11-phenyl-12-[3-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole?
5-[3-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole;7,7-dimethyl-5-[3-(9-phenylcarbazol-3-yl)phenyl]indeno[2,1-b]carbazole;11-phenyl-12-[3-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole has a molecular weight of 2056.59 g/mol, XLogP of 40.09, 10 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole;7,7-dimethyl-5-[3-(9-phenylcarbazol-3-yl)phenyl]indeno[2,1-b]carbazole;11-phenyl-12-[3-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole is sourced from PubChem (CID 160662276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).