3-[2-methyl-3-(9-phenylcarbazol-3-yl)phenyl]-9-phenylcarbazole

C43H30N2 — CID 89460166

IUPAC3-[2-methyl-3-(9-phenylcarbazol-3-yl)phenyl]-9-phenylcarbazole
SMILESCc1c(-c2ccc3c(c2)c2ccccc2n3-c2ccccc2)cccc1-c1ccc2c(c1)c1ccccc1n2-c1ccccc1
InChIInChI=1S/C43H30N2/c1-29-34(30-23-25-42-38(27-30)36-17-8-10-21-40(36)44(42)32-13-4-2-5-14-32)19-12-20-35(29)31-24-26-43-39(28-31)37-18-9-11-22-41(37)45(43)33-15-6-3-7-16-33/h2-28H,1H3
InChIKeyHHCMGBLLAUAEIY-UHFFFAOYSA-N
MW574.73 g/mol
LogP11.52
Rot. Bonds4

About 3-[2-methyl-3-(9-phenylcarbazol-3-yl)phenyl]-9-phenylcarbazole

3-[2-methyl-3-(9-phenylcarbazol-3-yl)phenyl]-9-phenylcarbazole (PubChem CID 89460166) has the molecular formula C43H30N2 and a molecular weight of 574.73 g/mol. Its IUPAC name is 3-[2-methyl-3-(9-phenylcarbazol-3-yl)phenyl]-9-phenylcarbazole.

Molecular Properties

Compound Name3-[2-methyl-3-(9-phenylcarbazol-3-yl)phenyl]-9-phenylcarbazole
PubChem CID89460166
Molecular FormulaC43H30N2
Molecular Weight574.73 g/mol
Exact Mass574.24
IUPAC Name3-[2-methyl-3-(9-phenylcarbazol-3-yl)phenyl]-9-phenylcarbazole
SMILESCc1c(-c2ccc3c(c2)c2ccccc2n3-c2ccccc2)cccc1-c1ccc2c(c1)c1ccccc1n2-c1ccccc1
InChIInChI=1S/C43H30N2/c1-29-34(30-23-25-42-38(27-30)36-17-8-10-21-40(36)44(42)32-13-4-2-5-14-32)19-12-20-35(29)31-24-26-43-39(28-31)37-18-9-11-22-41(37)45(43)33-15-6-3-7-16-33/h2-28H,1H3
InChIKeyHHCMGBLLAUAEIY-UHFFFAOYSA-N
XLogP11.52
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500574.73
LogP ≤ 511.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-methylphenyl]-9-phenylcarbazole
CID 122224307
3-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]-9-phenylcarbazole
CID 118404981
9-phenyl-3-[2-(9-phenylcarbazol-3-yl)phenyl]carbazole;9-phenyl-3-[3-(9-phenylcarbazol-3-yl)phenyl]carbazole;9-phenyl-3-[4-(9-phenylcarbazol-3-yl)phenyl]carbazole;9-phenyl-3-[2-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]carbazole;9-phenyl-3-[2-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]carbazole;9-phenyl-3-[3-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]carbazole;9-phenyl-3-[3-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]carbazole;9-phenyl-3-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]carbazole
CID 160831831
3-naphthalen-1-yl-9-phenyl-6-[2-(9-phenylcarbazol-3-yl)phenyl]carbazole
CID 126764169
3-(10-methylanthracen-9-yl)-9-phenylcarbazole
CID 121339805
3-(9-phenylcarbazol-3-yl)-9-[2-[3-[4-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 154590325
3-[10-(4,5-diphenylanthracen-9-yl)-8-(9-phenylcarbazol-3-yl)anthracen-1-yl]-9-phenylcarbazole
CID 155333594
3-(2-carbazol-9-ylphenyl)-9-[3-(9-phenylcarbazol-3-yl)phenyl]carbazole
CID 170060036
3-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]-9-(3-phenylphenyl)carbazole;3-[3-[3-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-9-(3-phenylphenyl)carbazole;3-[4-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-9-(3-phenylphenyl)carbazole
CID 158212129
3-[4-(6,9-diphenylcarbazol-3-yl)phenyl]-6,9-diphenylcarbazole;9-phenyl-3-[4-(9-phenylcarbazol-3-yl)phenyl]-6-(3-phenylphenyl)carbazole;9-phenyl-3-[4-(9-phenylcarbazol-3-yl)phenyl]-6-(4-phenylphenyl)carbazole;9-phenyl-3-(4-phenylphenyl)-6-[4-[9-phenyl-6-(4-phenylphenyl)carbazol-3-yl]phenyl]carbazole
CID 165019259
3,9-diphenyl-6-[3-[3-[3-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]phenyl]carbazole;3,9-diphenyl-6-[4-[4-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]phenyl]carbazole
CID 161263241
3-[9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 90085403

Frequently Asked Questions

What is the IUPAC name of 3-[2-methyl-3-(9-phenylcarbazol-3-yl)phenyl]-9-phenylcarbazole?
The IUPAC name of 3-[2-methyl-3-(9-phenylcarbazol-3-yl)phenyl]-9-phenylcarbazole (CID 89460166) is 3-[2-methyl-3-(9-phenylcarbazol-3-yl)phenyl]-9-phenylcarbazole.
What is the SMILES notation for 3-[2-methyl-3-(9-phenylcarbazol-3-yl)phenyl]-9-phenylcarbazole?
The canonical SMILES for 3-[2-methyl-3-(9-phenylcarbazol-3-yl)phenyl]-9-phenylcarbazole is Cc1c(-c2ccc3c(c2)c2ccccc2n3-c2ccccc2)cccc1-c1ccc2c(c1)c1ccccc1n2-c1ccccc1.
What is the InChIKey of 3-[2-methyl-3-(9-phenylcarbazol-3-yl)phenyl]-9-phenylcarbazole?
The InChIKey is HHCMGBLLAUAEIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H30N2/c1-29-34(30-23-25-42-38(27-30)36-17-8-10-21-40(36)44(42)32-13-4-2-5-14-32)19-12-20-35(29)31-24-26-43-39(28-31)37-18-9-11-22-41(37)45(43)33-15-6-3-7-16-33/h2-28H,1H3.
What are the key properties of 3-[2-methyl-3-(9-phenylcarbazol-3-yl)phenyl]-9-phenylcarbazole?
3-[2-methyl-3-(9-phenylcarbazol-3-yl)phenyl]-9-phenylcarbazole has a molecular weight of 574.73 g/mol, XLogP of 11.52, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-methyl-3-(9-phenylcarbazol-3-yl)phenyl]-9-phenylcarbazole is sourced from PubChem (CID 89460166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).