5-phenyl-8-(9-phenylpyrido[2,3-b]indol-6-yl)pyrido[4,3-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[3,2-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[4,3-b]indole

C102H66N12 — CID 159102469

IUPAC5-phenyl-8-(9-phenylpyrido[2,3-b]indol-6-yl)pyrido[4,3-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[3,2-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[4,3-b]indole
SMILESc1ccc(-n2c3ccc(-c4ccc5c(c4)c4ncccc4n5-c4ccccc4)cc3c3ccncc32)cc1.c1ccc(-n2c3ccncc3c3cc(-c4ccc5c(c4)c4cccnc4n5-c4ccccc4)ccc32)cc1.c1ccc(-n2c3ccncc3c3cc(-c4ccc5c(c4)c4ccncc4n5-c4ccccc4)ccc32)cc1
InChIInChI=1S/3C34H22N4/c1-3-8-25(9-4-1)37-31-15-13-24(21-29(31)30-22-35-19-17-33(30)37)23-14-16-32-28(20-23)27-12-7-18-36-34(27)38(32)26-10-5-2-6-11-26;1-3-8-25(9-4-1)37-31-16-14-24(21-29(31)34-32(37)12-7-18-36-34)23-13-15-30-28(20-23)27-17-19-35-22-33(27)38(30)26-10-5-2-6-11-26;1-3-7-25(8-4-1)37-32-14-12-24(20-29(32)30-21-35-18-16-33(30)37)23-11-13-31-28(19-23)27-15-17-36-22-34(27)38(31)26-9-5-2-6-10-26/h3*1-22H
InChIKeyKDLOGILNNVXTIW-UHFFFAOYSA-N
MW1459.73 g/mol
LogP25.01
Rot. Bonds9

About 5-phenyl-8-(9-phenylpyrido[2,3-b]indol-6-yl)pyrido[4,3-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[3,2-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[4,3-b]indole

5-phenyl-8-(9-phenylpyrido[2,3-b]indol-6-yl)pyrido[4,3-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[3,2-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[4,3-b]indole (PubChem CID 159102469) has the molecular formula C102H66N12 and a molecular weight of 1459.73 g/mol. Its IUPAC name is 5-phenyl-8-(9-phenylpyrido[2,3-b]indol-6-yl)pyrido[4,3-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[3,2-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[4,3-b]indole.

Molecular Properties

Compound Name5-phenyl-8-(9-phenylpyrido[2,3-b]indol-6-yl)pyrido[4,3-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[3,2-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[4,3-b]indole
PubChem CID159102469
Molecular FormulaC102H66N12
Molecular Weight1459.73 g/mol
Exact Mass1458.55
IUPAC Name5-phenyl-8-(9-phenylpyrido[2,3-b]indol-6-yl)pyrido[4,3-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[3,2-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[4,3-b]indole
SMILESc1ccc(-n2c3ccc(-c4ccc5c(c4)c4ncccc4n5-c4ccccc4)cc3c3ccncc32)cc1.c1ccc(-n2c3ccncc3c3cc(-c4ccc5c(c4)c4cccnc4n5-c4ccccc4)ccc32)cc1.c1ccc(-n2c3ccncc3c3cc(-c4ccc5c(c4)c4ccncc4n5-c4ccccc4)ccc32)cc1
InChIInChI=1S/3C34H22N4/c1-3-8-25(9-4-1)37-31-15-13-24(21-29(31)30-22-35-19-17-33(30)37)23-14-16-32-28(20-23)27-12-7-18-36-34(27)38(32)26-10-5-2-6-11-26;1-3-8-25(9-4-1)37-31-16-14-24(21-29(31)34-32(37)12-7-18-36-34)23-13-15-30-28(20-23)27-17-19-35-22-33(27)38(30)26-10-5-2-6-11-26;1-3-7-25(8-4-1)37-32-14-12-24(20-29(32)30-21-35-18-16-33(30)37)23-11-13-31-28(19-23)27-15-17-36-22-34(27)38(31)26-9-5-2-6-10-26/h3*1-22H
InChIKeyKDLOGILNNVXTIW-UHFFFAOYSA-N
XLogP25.01
TPSA106.92 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds9
Heavy Atoms114
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001459.73
LogP ≤ 525.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 5-phenyl-8-(9-phenylpyrido[2,3-b]indol-6-yl)pyrido[4,3-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[3,2-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[4,3-b]indole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-phenyl-8-(9-phenylpyrido[2,3-b]indol-6-yl)pyrido[4,3-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[3,2-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[4,3-b]indole?
The IUPAC name of 5-phenyl-8-(9-phenylpyrido[2,3-b]indol-6-yl)pyrido[4,3-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[3,2-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[4,3-b]indole (CID 159102469) is 5-phenyl-8-(9-phenylpyrido[2,3-b]indol-6-yl)pyrido[4,3-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[3,2-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[4,3-b]indole.
What is the SMILES notation for 5-phenyl-8-(9-phenylpyrido[2,3-b]indol-6-yl)pyrido[4,3-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[3,2-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[4,3-b]indole?
The canonical SMILES for 5-phenyl-8-(9-phenylpyrido[2,3-b]indol-6-yl)pyrido[4,3-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[3,2-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[4,3-b]indole is c1ccc(-n2c3ccc(-c4ccc5c(c4)c4ncccc4n5-c4ccccc4)cc3c3ccncc32)cc1.c1ccc(-n2c3ccncc3c3cc(-c4ccc5c(c4)c4cccnc4n5-c4ccccc4)ccc32)cc1.c1ccc(-n2c3ccncc3c3cc(-c4ccc5c(c4)c4ccncc4n5-c4ccccc4)ccc32)cc1.
What is the InChIKey of 5-phenyl-8-(9-phenylpyrido[2,3-b]indol-6-yl)pyrido[4,3-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[3,2-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[4,3-b]indole?
The InChIKey is KDLOGILNNVXTIW-UHFFFAOYSA-N. The full InChI is InChI=1S/3C34H22N4/c1-3-8-25(9-4-1)37-31-15-13-24(21-29(31)30-22-35-19-17-33(30)37)23-14-16-32-28(20-23)27-12-7-18-36-34(27)38(32)26-10-5-2-6-11-26;1-3-8-25(9-4-1)37-31-16-14-24(21-29(31)34-32(37)12-7-18-36-34)23-13-15-30-28(20-23)27-17-19-35-22-33(27)38(30)26-10-5-2-6-11-26;1-3-7-25(8-4-1)37-32-14-12-24(20-29(32)30-21-35-18-16-33(30)37)23-11-13-31-28(19-23)27-15-17-36-22-34(27)38(31)26-9-5-2-6-10-26/h3*1-22H.
What are the key properties of 5-phenyl-8-(9-phenylpyrido[2,3-b]indol-6-yl)pyrido[4,3-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[3,2-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[4,3-b]indole?
5-phenyl-8-(9-phenylpyrido[2,3-b]indol-6-yl)pyrido[4,3-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[3,2-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[4,3-b]indole has a molecular weight of 1459.73 g/mol, XLogP of 25.01, 9 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-8-(9-phenylpyrido[2,3-b]indol-6-yl)pyrido[4,3-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[3,2-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[4,3-b]indole is sourced from PubChem (CID 159102469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).