6-[3-(4-methylphenyl)phenyl]-9-(3-phenylphenyl)-3,4-dihydrocarbazole

C37H29N — CID 144639948

IUPAC6-[3-(4-methylphenyl)phenyl]-9-(3-phenylphenyl)-3,4-dihydrocarbazole
SMILESCc1ccc(-c2cccc(-c3ccc4c(c3)c3c(n4-c4cccc(-c5ccccc5)c4)C=CCC3)c2)cc1
InChIInChI=1S/C37H29N/c1-26-17-19-28(20-18-26)29-11-7-12-30(23-29)32-21-22-37-35(25-32)34-15-5-6-16-36(34)38(37)33-14-8-13-31(24-33)27-9-3-2-4-10-27/h2-4,6-14,16-25H,5,15H2,1H3
InChIKeyQOLZJKSJYRTGPA-UHFFFAOYSA-N
MW487.65 g/mol
LogP9.90
Rot. Bonds4

About 6-[3-(4-methylphenyl)phenyl]-9-(3-phenylphenyl)-3,4-dihydrocarbazole

6-[3-(4-methylphenyl)phenyl]-9-(3-phenylphenyl)-3,4-dihydrocarbazole (PubChem CID 144639948) has the molecular formula C37H29N and a molecular weight of 487.65 g/mol. Its IUPAC name is 6-[3-(4-methylphenyl)phenyl]-9-(3-phenylphenyl)-3,4-dihydrocarbazole.

Molecular Properties

Compound Name6-[3-(4-methylphenyl)phenyl]-9-(3-phenylphenyl)-3,4-dihydrocarbazole
PubChem CID144639948
Molecular FormulaC37H29N
Molecular Weight487.65 g/mol
Exact Mass487.23
IUPAC Name6-[3-(4-methylphenyl)phenyl]-9-(3-phenylphenyl)-3,4-dihydrocarbazole
SMILESCc1ccc(-c2cccc(-c3ccc4c(c3)c3c(n4-c4cccc(-c5ccccc5)c4)C=CCC3)c2)cc1
InChIInChI=1S/C37H29N/c1-26-17-19-28(20-18-26)29-11-7-12-30(23-29)32-21-22-37-35(25-32)34-15-5-6-16-36(34)38(37)33-14-8-13-31(24-33)27-9-3-2-4-10-27/h2-4,6-14,16-25H,5,15H2,1H3
InChIKeyQOLZJKSJYRTGPA-UHFFFAOYSA-N
XLogP9.90
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500487.65
LogP ≤ 59.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

5,11-bis(3-phenylphenyl)-7,8-dihydroindolo[3,2-b]carbazole
CID 123303994
2-(6-carbazol-9-yl-3,4-dihydrocarbazol-9-yl)-9-[3-(3-phenylphenyl)phenyl]carbazole
CID 170372272
9-(4-phenylphenyl)-3-[9-(3-phenylphenyl)-5,6-dihydrocarbazol-2-yl]carbazole
CID 123902449
N-[4-[3-(3,4-dihydrocarbazol-9-yl)phenyl]phenyl]-4-phenylaniline
CID 146356785
3-[3-[9-[4-(4-phenylphenyl)phenyl]-5,6-dihydrocarbazol-3-yl]carbazol-9-yl]benzonitrile
CID 163484812
5,11-bis(4-methylphenyl)-7,8-dihydroindolo[3,2-b]carbazole
CID 71134727
3-[3-(4-methylphenyl)phenyl]-9-(3-phenylphenyl)carbazole
CID 144639934
9-phenyl-2-(9-triphenylen-2-yl-5,6-dihydrocarbazol-3-yl)carbazole
CID 163694127
6-tert-butyl-9-phenyl-3,4-dihydrocarbazole
CID 134351479
3-[9-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]-5,6-dihydrocarbazol-3-yl]-9-phenylcarbazole
CID 89431253
9-[3-(3,5-diphenylphenyl)phenyl]-3,6-diphenylcarbazole
CID 166509860
9-[3-[3-[4,6-di(dibenzofuran-3-yl)-1,3,5-triazin-2-yl]phenyl]phenyl]-3,4-dihydrocarbazole
CID 174291367

Frequently Asked Questions

What is the IUPAC name of 6-[3-(4-methylphenyl)phenyl]-9-(3-phenylphenyl)-3,4-dihydrocarbazole?
The IUPAC name of 6-[3-(4-methylphenyl)phenyl]-9-(3-phenylphenyl)-3,4-dihydrocarbazole (CID 144639948) is 6-[3-(4-methylphenyl)phenyl]-9-(3-phenylphenyl)-3,4-dihydrocarbazole.
What is the SMILES notation for 6-[3-(4-methylphenyl)phenyl]-9-(3-phenylphenyl)-3,4-dihydrocarbazole?
The canonical SMILES for 6-[3-(4-methylphenyl)phenyl]-9-(3-phenylphenyl)-3,4-dihydrocarbazole is Cc1ccc(-c2cccc(-c3ccc4c(c3)c3c(n4-c4cccc(-c5ccccc5)c4)C=CCC3)c2)cc1.
What is the InChIKey of 6-[3-(4-methylphenyl)phenyl]-9-(3-phenylphenyl)-3,4-dihydrocarbazole?
The InChIKey is QOLZJKSJYRTGPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H29N/c1-26-17-19-28(20-18-26)29-11-7-12-30(23-29)32-21-22-37-35(25-32)34-15-5-6-16-36(34)38(37)33-14-8-13-31(24-33)27-9-3-2-4-10-27/h2-4,6-14,16-25H,5,15H2,1H3.
What are the key properties of 6-[3-(4-methylphenyl)phenyl]-9-(3-phenylphenyl)-3,4-dihydrocarbazole?
6-[3-(4-methylphenyl)phenyl]-9-(3-phenylphenyl)-3,4-dihydrocarbazole has a molecular weight of 487.65 g/mol, XLogP of 9.90, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-(4-methylphenyl)phenyl]-9-(3-phenylphenyl)-3,4-dihydrocarbazole is sourced from PubChem (CID 144639948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).