5-phenyl-12-(5-phenylpyrido[4,3-b]indol-8-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[2,3-b]indol-6-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[3,4-b]indol-6-yl)indolo[3,2-c]carbazole

C123H78N12 — CID 162215345

IUPAC5-phenyl-12-(5-phenylpyrido[4,3-b]indol-8-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[2,3-b]indol-6-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[3,4-b]indol-6-yl)indolo[3,2-c]carbazole
SMILESc1ccc(-n2c3ccc(-n4c5ccccc5c5ccc6c(c7ccccc7n6-c6ccccc6)c54)cc3c3ccncc32)cc1.c1ccc(-n2c3ccccc3c3c2ccc2c4ccccc4n(-c4ccc5c(c4)c4cccnc4n5-c4ccccc4)c23)cc1.c1ccc(-n2c3ccncc3c3cc(-n4c5ccccc5c5ccc6c(c7ccccc7n6-c6ccccc6)c54)ccc32)cc1
InChIInChI=1S/3C41H26N4/c1-3-12-27(13-4-1)43-36-20-10-8-17-33(36)39-38(43)24-22-31-30-16-7-9-19-35(30)44(40(31)39)29-21-23-37-34(26-29)32-18-11-25-42-41(32)45(37)28-14-5-2-6-15-28;1-3-11-27(12-4-1)43-36-18-10-8-16-33(36)40-38(43)22-20-32-30-15-7-9-17-35(30)45(41(32)40)29-19-21-37-34(25-29)31-23-24-42-26-39(31)44(37)28-13-5-2-6-14-28;1-3-11-27(12-4-1)43-37-21-19-29(25-33(37)34-26-42-24-23-38(34)43)45-35-17-9-7-15-30(35)31-20-22-39-40(41(31)45)32-16-8-10-18-36(32)44(39)28-13-5-2-6-14-28/h3*1-26H
InChIKeyZTJQUXOJHQXYMR-UHFFFAOYSA-N
MW1724.06 g/mol
LogP31.12
Rot. Bonds9

About 5-phenyl-12-(5-phenylpyrido[4,3-b]indol-8-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[2,3-b]indol-6-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[3,4-b]indol-6-yl)indolo[3,2-c]carbazole

5-phenyl-12-(5-phenylpyrido[4,3-b]indol-8-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[2,3-b]indol-6-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[3,4-b]indol-6-yl)indolo[3,2-c]carbazole (PubChem CID 162215345) has the molecular formula C123H78N12 and a molecular weight of 1724.06 g/mol. Its IUPAC name is 5-phenyl-12-(5-phenylpyrido[4,3-b]indol-8-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[2,3-b]indol-6-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[3,4-b]indol-6-yl)indolo[3,2-c]carbazole.

Molecular Properties

Compound Name5-phenyl-12-(5-phenylpyrido[4,3-b]indol-8-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[2,3-b]indol-6-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[3,4-b]indol-6-yl)indolo[3,2-c]carbazole
PubChem CID162215345
Molecular FormulaC123H78N12
Molecular Weight1724.06 g/mol
Exact Mass1722.65
IUPAC Name5-phenyl-12-(5-phenylpyrido[4,3-b]indol-8-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[2,3-b]indol-6-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[3,4-b]indol-6-yl)indolo[3,2-c]carbazole
SMILESc1ccc(-n2c3ccc(-n4c5ccccc5c5ccc6c(c7ccccc7n6-c6ccccc6)c54)cc3c3ccncc32)cc1.c1ccc(-n2c3ccccc3c3c2ccc2c4ccccc4n(-c4ccc5c(c4)c4cccnc4n5-c4ccccc4)c23)cc1.c1ccc(-n2c3ccncc3c3cc(-n4c5ccccc5c5ccc6c(c7ccccc7n6-c6ccccc6)c54)ccc32)cc1
InChIInChI=1S/3C41H26N4/c1-3-12-27(13-4-1)43-36-20-10-8-17-33(36)39-38(43)24-22-31-30-16-7-9-19-35(30)44(40(31)39)29-21-23-37-34(26-29)32-18-11-25-42-41(32)45(37)28-14-5-2-6-15-28;1-3-11-27(12-4-1)43-36-18-10-8-16-33(36)40-38(43)22-20-32-30-15-7-9-17-35(30)45(41(32)40)29-19-21-37-34(25-29)31-23-24-42-26-39(31)44(37)28-13-5-2-6-14-28;1-3-11-27(12-4-1)43-37-21-19-29(25-33(37)34-26-42-24-23-38(34)43)45-35-17-9-7-15-30(35)31-20-22-39-40(41(31)45)32-16-8-10-18-36(32)44(39)28-13-5-2-6-14-28/h3*1-26H
InChIKeyZTJQUXOJHQXYMR-UHFFFAOYSA-N
XLogP31.12
TPSA83.04 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds9
Heavy Atoms135
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001724.06
LogP ≤ 531.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 5-phenyl-12-(5-phenylpyrido[4,3-b]indol-8-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[2,3-b]indol-6-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[3,4-b]indol-6-yl)indolo[3,2-c]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-phenyl-12-(5-phenylpyrido[4,3-b]indol-8-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[2,3-b]indol-6-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[3,4-b]indol-6-yl)indolo[3,2-c]carbazole?
The IUPAC name of 5-phenyl-12-(5-phenylpyrido[4,3-b]indol-8-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[2,3-b]indol-6-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[3,4-b]indol-6-yl)indolo[3,2-c]carbazole (CID 162215345) is 5-phenyl-12-(5-phenylpyrido[4,3-b]indol-8-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[2,3-b]indol-6-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[3,4-b]indol-6-yl)indolo[3,2-c]carbazole.
What is the SMILES notation for 5-phenyl-12-(5-phenylpyrido[4,3-b]indol-8-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[2,3-b]indol-6-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[3,4-b]indol-6-yl)indolo[3,2-c]carbazole?
The canonical SMILES for 5-phenyl-12-(5-phenylpyrido[4,3-b]indol-8-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[2,3-b]indol-6-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[3,4-b]indol-6-yl)indolo[3,2-c]carbazole is c1ccc(-n2c3ccc(-n4c5ccccc5c5ccc6c(c7ccccc7n6-c6ccccc6)c54)cc3c3ccncc32)cc1.c1ccc(-n2c3ccccc3c3c2ccc2c4ccccc4n(-c4ccc5c(c4)c4cccnc4n5-c4ccccc4)c23)cc1.c1ccc(-n2c3ccncc3c3cc(-n4c5ccccc5c5ccc6c(c7ccccc7n6-c6ccccc6)c54)ccc32)cc1.
What is the InChIKey of 5-phenyl-12-(5-phenylpyrido[4,3-b]indol-8-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[2,3-b]indol-6-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[3,4-b]indol-6-yl)indolo[3,2-c]carbazole?
The InChIKey is ZTJQUXOJHQXYMR-UHFFFAOYSA-N. The full InChI is InChI=1S/3C41H26N4/c1-3-12-27(13-4-1)43-36-20-10-8-17-33(36)39-38(43)24-22-31-30-16-7-9-19-35(30)44(40(31)39)29-21-23-37-34(26-29)32-18-11-25-42-41(32)45(37)28-14-5-2-6-15-28;1-3-11-27(12-4-1)43-36-18-10-8-16-33(36)40-38(43)22-20-32-30-15-7-9-17-35(30)45(41(32)40)29-19-21-37-34(25-29)31-23-24-42-26-39(31)44(37)28-13-5-2-6-14-28;1-3-11-27(12-4-1)43-37-21-19-29(25-33(37)34-26-42-24-23-38(34)43)45-35-17-9-7-15-30(35)31-20-22-39-40(41(31)45)32-16-8-10-18-36(32)44(39)28-13-5-2-6-14-28/h3*1-26H.
What are the key properties of 5-phenyl-12-(5-phenylpyrido[4,3-b]indol-8-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[2,3-b]indol-6-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[3,4-b]indol-6-yl)indolo[3,2-c]carbazole?
5-phenyl-12-(5-phenylpyrido[4,3-b]indol-8-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[2,3-b]indol-6-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[3,4-b]indol-6-yl)indolo[3,2-c]carbazole has a molecular weight of 1724.06 g/mol, XLogP of 31.12, 9 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-12-(5-phenylpyrido[4,3-b]indol-8-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[2,3-b]indol-6-yl)indolo[3,2-c]carbazole;5-phenyl-12-(9-phenylpyrido[3,4-b]indol-6-yl)indolo[3,2-c]carbazole is sourced from PubChem (CID 162215345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).