9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-4-yl]carbazole

C48H32N2 — CID 146187387

IUPAC9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-4-yl]carbazole
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5cccc6c5c5ccccc5n6-c5ccc(-c6ccccc6)cc5)ccc43)cc2)cc1
InChIInChI=1S/C48H32N2/c1-3-12-33(13-4-1)35-22-27-38(28-23-35)49-44-19-9-7-16-41(44)43-32-37(26-31-46(43)49)40-18-11-21-47-48(40)42-17-8-10-20-45(42)50(47)39-29-24-36(25-30-39)34-14-5-2-6-15-34/h1-32H
InChIKeyKVAUFEBBTBYRHD-UHFFFAOYSA-N
MW636.80 g/mol
LogP12.88
Rot. Bonds5

About 9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-4-yl]carbazole

9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-4-yl]carbazole (PubChem CID 146187387) has the molecular formula C48H32N2 and a molecular weight of 636.80 g/mol. Its IUPAC name is 9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-4-yl]carbazole.

Molecular Properties

Compound Name9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-4-yl]carbazole
PubChem CID146187387
Molecular FormulaC48H32N2
Molecular Weight636.80 g/mol
Exact Mass636.26
IUPAC Name9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-4-yl]carbazole
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5cccc6c5c5ccccc5n6-c5ccc(-c6ccccc6)cc5)ccc43)cc2)cc1
InChIInChI=1S/C48H32N2/c1-3-12-33(13-4-1)35-22-27-38(28-23-35)49-44-19-9-7-16-41(44)43-32-37(26-31-46(43)49)40-18-11-21-47-48(40)42-17-8-10-20-45(42)50(47)39-29-24-36(25-30-39)34-14-5-2-6-15-34/h1-32H
InChIKeyKVAUFEBBTBYRHD-UHFFFAOYSA-N
XLogP12.88
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500636.80
LogP ≤ 512.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole
CID 165386055
5,9-diphenyl-3-(9-phenylcarbazol-3-yl)carbazole;5-phenyl-3-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole
CID 160685377
5,9-diphenyl-3-(9-phenylcarbazol-3-yl)carbazole;9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 162115946
9-phenyl-5-(4-phenylphenyl)-3-[9-[4-(4-phenylphenyl)phenyl]carbazol-3-yl]carbazole
CID 170073009
3-[9-[4-(3,5-diphenylphenyl)phenyl]carbazol-4-yl]-9-phenylcarbazole;3-[9-[4-(3,5-diphenylphenyl)phenyl]carbazol-3-yl]-9-(4-phenylphenyl)carbazole;2-(9-phenylcarbazol-2-yl)-9-(4-phenylphenyl)carbazole;4-(9-phenylcarbazol-3-yl)-9-[4-(4-phenylphenyl)phenyl]carbazole;9-phenyl-2-(9-phenylcarbazol-2-yl)carbazole
CID 161127912
4-(3-phenylphenyl)-9-(4-phenylphenyl)carbazole
CID 166660662
3-[4-[9-(4-carbazol-9-ylphenyl)carbazol-4-yl]carbazol-9-yl]-9-phenylcarbazole;3,9-diphenyl-6-[4-(9-phenylcarbazol-4-yl)carbazol-9-yl]carbazole
CID 159143760
5-[3-(9-phenylcarbazol-3-yl)phenyl]-7-(3-phenylphenyl)indolo[2,3-b]carbazole;5-[3-(9-phenylcarbazol-4-yl)phenyl]-7-(4-phenylphenyl)indolo[2,3-b]carbazole;5-[4-(9-phenylcarbazol-4-yl)phenyl]-7-(4-phenylphenyl)indolo[2,3-b]carbazole;7-phenyl-5-[4-(9-phenylcarbazol-4-yl)phenyl]indolo[2,3-b]carbazole
CID 157490123
9-phenyl-3-(9-phenylcarbazol-3-yl)-5-[4-(4-phenylphenyl)phenyl]carbazole
CID 134369783
3-(9-phenylcarbazol-4-yl)-9-triphenylen-2-ylcarbazole
CID 146270951
5-(3-phenylphenyl)-9-(4-phenylphenyl)-3-[4-[9-(2-phenylphenyl)carbazol-3-yl]phenyl]carbazole
CID 139319559
3,9-diphenyl-6-[2-(9-phenylcarbazol-2-yl)-5-[4-[3-[2-[9-(4-phenylphenyl)carbazol-2-yl]carbazol-9-yl]carbazol-9-yl]phenyl]carbazol-9-yl]carbazole
CID 137420817

Frequently Asked Questions

What is the IUPAC name of 9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-4-yl]carbazole?
The IUPAC name of 9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-4-yl]carbazole (CID 146187387) is 9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-4-yl]carbazole.
What is the SMILES notation for 9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-4-yl]carbazole?
The canonical SMILES for 9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-4-yl]carbazole is c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5cccc6c5c5ccccc5n6-c5ccc(-c6ccccc6)cc5)ccc43)cc2)cc1.
What is the InChIKey of 9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-4-yl]carbazole?
The InChIKey is KVAUFEBBTBYRHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H32N2/c1-3-12-33(13-4-1)35-22-27-38(28-23-35)49-44-19-9-7-16-41(44)43-32-37(26-31-46(43)49)40-18-11-21-47-48(40)42-17-8-10-20-45(42)50(47)39-29-24-36(25-30-39)34-14-5-2-6-15-34/h1-32H.
What are the key properties of 9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-4-yl]carbazole?
9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-4-yl]carbazole has a molecular weight of 636.80 g/mol, XLogP of 12.88, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-4-yl]carbazole is sourced from PubChem (CID 146187387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).