5-[3-(3,5-diphenylphenyl)-5-methylphenyl]pyrido[4,3-b]indole

C36H26N2 — CID 143691808

IUPAC5-[3-(3,5-diphenylphenyl)-5-methylphenyl]pyrido[4,3-b]indole
SMILESCc1cc(-c2cc(-c3ccccc3)cc(-c3ccccc3)c2)cc(-n2c3ccccc3c3cnccc32)c1
InChIInChI=1S/C36H26N2/c1-25-18-28(23-32(19-25)38-35-15-9-8-14-33(35)34-24-37-17-16-36(34)38)31-21-29(26-10-4-2-5-11-26)20-30(22-31)27-12-6-3-7-13-27/h2-24H,1H3
InChIKeyMUSPREAVAQQRQY-UHFFFAOYSA-N
MW486.62 g/mol
LogP9.49
Rot. Bonds4

About 5-[3-(3,5-diphenylphenyl)-5-methylphenyl]pyrido[4,3-b]indole

5-[3-(3,5-diphenylphenyl)-5-methylphenyl]pyrido[4,3-b]indole (PubChem CID 143691808) has the molecular formula C36H26N2 and a molecular weight of 486.62 g/mol. Its IUPAC name is 5-[3-(3,5-diphenylphenyl)-5-methylphenyl]pyrido[4,3-b]indole.

Molecular Properties

Compound Name5-[3-(3,5-diphenylphenyl)-5-methylphenyl]pyrido[4,3-b]indole
PubChem CID143691808
Molecular FormulaC36H26N2
Molecular Weight486.62 g/mol
Exact Mass486.21
IUPAC Name5-[3-(3,5-diphenylphenyl)-5-methylphenyl]pyrido[4,3-b]indole
SMILESCc1cc(-c2cc(-c3ccccc3)cc(-c3ccccc3)c2)cc(-n2c3ccccc3c3cnccc32)c1
InChIInChI=1S/C36H26N2/c1-25-18-28(23-32(19-25)38-35-15-9-8-14-33(35)34-24-37-17-16-36(34)38)31-21-29(26-10-4-2-5-11-26)20-30(22-31)27-12-6-3-7-13-27/h2-24H,1H3
InChIKeyMUSPREAVAQQRQY-UHFFFAOYSA-N
XLogP9.49
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500486.62
LogP ≤ 59.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-[3-(3,5-diphenylphenyl)-5-methylphenyl]pyrido[4,3-b]indole;ethane;4-methyl-3-(2-methylphenyl)pyridine
CID 143691807
5-[3,5-bis[3-(5-pyridin-4-yl-3-pyridinyl)phenyl]phenyl]pyrido[4,3-b]indole
CID 164785743
9-(3,5-diphenylphenyl)carbazole
CID 86068368
5-(3-carbazol-9-ylphenyl)-8-phenylpyrido[4,3-b]indole
CID 170060228
3-[9-[3-(3,5-diphenylphenyl)-5-methylphenyl]carbazol-2-yl]-9-phenylcarbazole
CID 144560195
9-[3-carbazol-9-yl-5-(3-carbazol-9-yl-5-phenylphenyl)phenyl]carbazole
CID 58769488
9-[3-[3-(3-carbazol-9-ylphenyl)-5-methylphenyl]phenyl]carbazole
CID 59841971
5-[4-[3,5-bis(pyrido[4,3-b]indol-5-yl)phenyl]phenyl]-N,N-diphenylpyrido[4,3-b]indol-8-amine
CID 135252593
9-[3-carbazol-9-yl-5-[3-phenyl-5-(4-phenylphenyl)phenyl]phenyl]carbazole
CID 176740225
8-[4-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-5-phenylpyrido[4,3-b]indole
CID 170060405
3-(3-methyl-5-phenylphenyl)-9-phenylcarbazole
CID 123628919
8-carbazol-9-yl-5-phenylpyrido[4,3-b]indole
CID 149133438

Frequently Asked Questions

What is the IUPAC name of 5-[3-(3,5-diphenylphenyl)-5-methylphenyl]pyrido[4,3-b]indole?
The IUPAC name of 5-[3-(3,5-diphenylphenyl)-5-methylphenyl]pyrido[4,3-b]indole (CID 143691808) is 5-[3-(3,5-diphenylphenyl)-5-methylphenyl]pyrido[4,3-b]indole.
What is the SMILES notation for 5-[3-(3,5-diphenylphenyl)-5-methylphenyl]pyrido[4,3-b]indole?
The canonical SMILES for 5-[3-(3,5-diphenylphenyl)-5-methylphenyl]pyrido[4,3-b]indole is Cc1cc(-c2cc(-c3ccccc3)cc(-c3ccccc3)c2)cc(-n2c3ccccc3c3cnccc32)c1.
What is the InChIKey of 5-[3-(3,5-diphenylphenyl)-5-methylphenyl]pyrido[4,3-b]indole?
The InChIKey is MUSPREAVAQQRQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H26N2/c1-25-18-28(23-32(19-25)38-35-15-9-8-14-33(35)34-24-37-17-16-36(34)38)31-21-29(26-10-4-2-5-11-26)20-30(22-31)27-12-6-3-7-13-27/h2-24H,1H3.
What are the key properties of 5-[3-(3,5-diphenylphenyl)-5-methylphenyl]pyrido[4,3-b]indole?
5-[3-(3,5-diphenylphenyl)-5-methylphenyl]pyrido[4,3-b]indole has a molecular weight of 486.62 g/mol, XLogP of 9.49, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(3,5-diphenylphenyl)-5-methylphenyl]pyrido[4,3-b]indole is sourced from PubChem (CID 143691808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).