4-(9-dibenzofuran-2-ylcarbazol-2-yl)-3,9-diphenylcarbazole

C48H30N2O — CID 90321713

IUPAC4-(9-dibenzofuran-2-ylcarbazol-2-yl)-3,9-diphenylcarbazole
SMILESc1ccc(-c2ccc3c(c2-c2ccc4c5ccccc5n(-c5ccc6oc7ccccc7c6c5)c4c2)c2ccccc2n3-c2ccccc2)cc1
InChIInChI=1S/C48H30N2O/c1-3-13-31(14-4-1)35-26-27-43-48(39-19-8-11-21-42(39)49(43)33-15-5-2-6-16-33)47(35)32-23-25-37-36-17-7-10-20-41(36)50(44(37)29-32)34-24-28-46-40(30-34)38-18-9-12-22-45(38)51-46/h1-30H
InChIKeyJNORKYGRLLLBOP-UHFFFAOYSA-N
MW650.78 g/mol
LogP13.11
Rot. Bonds4

About 4-(9-dibenzofuran-2-ylcarbazol-2-yl)-3,9-diphenylcarbazole

4-(9-dibenzofuran-2-ylcarbazol-2-yl)-3,9-diphenylcarbazole (PubChem CID 90321713) has the molecular formula C48H30N2O and a molecular weight of 650.78 g/mol. Its IUPAC name is 4-(9-dibenzofuran-2-ylcarbazol-2-yl)-3,9-diphenylcarbazole.

Molecular Properties

Compound Name4-(9-dibenzofuran-2-ylcarbazol-2-yl)-3,9-diphenylcarbazole
PubChem CID90321713
Molecular FormulaC48H30N2O
Molecular Weight650.78 g/mol
Exact Mass650.24
IUPAC Name4-(9-dibenzofuran-2-ylcarbazol-2-yl)-3,9-diphenylcarbazole
SMILESc1ccc(-c2ccc3c(c2-c2ccc4c5ccccc5n(-c5ccc6oc7ccccc7c6c5)c4c2)c2ccccc2n3-c2ccccc2)cc1
InChIInChI=1S/C48H30N2O/c1-3-13-31(14-4-1)35-26-27-43-48(39-19-8-11-21-42(39)49(43)33-15-5-2-6-16-33)47(35)32-23-25-37-36-17-7-10-20-41(36)50(44(37)29-32)34-24-28-46-40(30-34)38-18-9-12-22-45(38)51-46/h1-30H
InChIKeyJNORKYGRLLLBOP-UHFFFAOYSA-N
XLogP13.11
TPSA23.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms51
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500650.78
LogP ≤ 513.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-(9-dibenzofuran-2-ylcarbazol-2-yl)-2,9-diphenylcarbazole
CID 90321574
2,6-bis(9-dibenzofuran-2-ylcarbazol-3-yl)-9-phenylcarbazole
CID 88594589
12-dibenzofuran-2-yl-5-(4-phenylphenyl)indolo[3,2-c]carbazole
CID 163700915
1-dibenzofuran-2-yl-2-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran;9-phenyl-2-[2-[4-(10-phenylanthracen-9-yl)phenyl]dibenzofuran-1-yl]carbazole
CID 167624935
3-[9-(10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14,16,18-nonaen-6-yl)carbazol-2-yl]-9-phenylcarbazole
CID 135171606
9-dibenzofuran-2-yl-3-phenyl-2-(9-phenylcarbazol-4-yl)carbazole
CID 90321522
3,9-bis(9-phenylcarbazol-3-yl)carbazole;3-[9-(4-dibenzofuran-2-ylphenyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;9-phenyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole;9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 158173584
3,6-bis(9-dibenzofuran-2-ylcarbazol-3-yl)-9-phenylcarbazole
CID 88594554
3-carbazol-9-yl-9-[8-[3-[3-(3-phenylphenyl)phenyl]phenyl]dibenzofuran-2-yl]carbazole;2-dibenzofuran-2-yl-9-[8-[3-(3-phenylphenyl)phenyl]dibenzofuran-2-yl]carbazole;9-[8-[3-(3-phenylphenyl)phenyl]dibenzofuran-2-yl]carbazole;3-phenyl-9-[8-[3-[3-(3-phenylphenyl)phenyl]phenyl]dibenzofuran-2-yl]carbazole;3-phenyl-9-[9-[8-[3-[3-(3-phenylphenyl)phenyl]phenyl]dibenzofuran-2-yl]carbazol-3-yl]carbazole
CID 159735182
12-dibenzofuran-2-yl-5-[3-(4-phenylphenyl)phenyl]indolo[3,2-c]carbazole
CID 122598858
9-dibenzofuran-2-yl-5-phenyl-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 170072865
3-[3-(3-dibenzofuran-2-ylphenyl)carbazol-9-yl]-9-[8-(9-phenylcarbazol-3-yl)dibenzofuran-2-yl]carbazole
CID 123419299

Frequently Asked Questions

What is the IUPAC name of 4-(9-dibenzofuran-2-ylcarbazol-2-yl)-3,9-diphenylcarbazole?
The IUPAC name of 4-(9-dibenzofuran-2-ylcarbazol-2-yl)-3,9-diphenylcarbazole (CID 90321713) is 4-(9-dibenzofuran-2-ylcarbazol-2-yl)-3,9-diphenylcarbazole.
What is the SMILES notation for 4-(9-dibenzofuran-2-ylcarbazol-2-yl)-3,9-diphenylcarbazole?
The canonical SMILES for 4-(9-dibenzofuran-2-ylcarbazol-2-yl)-3,9-diphenylcarbazole is c1ccc(-c2ccc3c(c2-c2ccc4c5ccccc5n(-c5ccc6oc7ccccc7c6c5)c4c2)c2ccccc2n3-c2ccccc2)cc1.
What is the InChIKey of 4-(9-dibenzofuran-2-ylcarbazol-2-yl)-3,9-diphenylcarbazole?
The InChIKey is JNORKYGRLLLBOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H30N2O/c1-3-13-31(14-4-1)35-26-27-43-48(39-19-8-11-21-42(39)49(43)33-15-5-2-6-16-33)47(35)32-23-25-37-36-17-7-10-20-41(36)50(44(37)29-32)34-24-28-46-40(30-34)38-18-9-12-22-45(38)51-46/h1-30H.
What are the key properties of 4-(9-dibenzofuran-2-ylcarbazol-2-yl)-3,9-diphenylcarbazole?
4-(9-dibenzofuran-2-ylcarbazol-2-yl)-3,9-diphenylcarbazole has a molecular weight of 650.78 g/mol, XLogP of 13.11, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(9-dibenzofuran-2-ylcarbazol-2-yl)-3,9-diphenylcarbazole is sourced from PubChem (CID 90321713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).