7-[4-(4-carbazol-9-ylphenyl)phenyl]-10-phenyl-[1]benzofuro[2,3-b]carbazole

C48H30N2O — CID 167192760

IUPAC7-[4-(4-carbazol-9-ylphenyl)phenyl]-10-phenyl-[1]benzofuro[2,3-b]carbazole
SMILESc1ccc(-c2ccc3c(c2)c2cc4c(cc2n3-c2ccc(-c3ccc(-n5c6ccccc6c6ccccc65)cc3)cc2)oc2ccccc24)cc1
InChIInChI=1S/C48H30N2O/c1-2-10-31(11-3-1)34-22-27-45-40(28-34)41-29-42-39-14-6-9-17-47(39)51-48(42)30-46(41)50(45)36-25-20-33(21-26-36)32-18-23-35(24-19-32)49-43-15-7-4-12-37(43)38-13-5-8-16-44(38)49/h1-30H
InChIKeyUSGQKIQRKOXSCE-UHFFFAOYSA-N
MW650.78 g/mol
LogP13.11
Rot. Bonds4

About 7-[4-(4-carbazol-9-ylphenyl)phenyl]-10-phenyl-[1]benzofuro[2,3-b]carbazole

7-[4-(4-carbazol-9-ylphenyl)phenyl]-10-phenyl-[1]benzofuro[2,3-b]carbazole (PubChem CID 167192760) has the molecular formula C48H30N2O and a molecular weight of 650.78 g/mol. Its IUPAC name is 7-[4-(4-carbazol-9-ylphenyl)phenyl]-10-phenyl-[1]benzofuro[2,3-b]carbazole.

Molecular Properties

Compound Name7-[4-(4-carbazol-9-ylphenyl)phenyl]-10-phenyl-[1]benzofuro[2,3-b]carbazole
PubChem CID167192760
Molecular FormulaC48H30N2O
Molecular Weight650.78 g/mol
Exact Mass650.24
IUPAC Name7-[4-(4-carbazol-9-ylphenyl)phenyl]-10-phenyl-[1]benzofuro[2,3-b]carbazole
SMILESc1ccc(-c2ccc3c(c2)c2cc4c(cc2n3-c2ccc(-c3ccc(-n5c6ccccc6c6ccccc65)cc3)cc2)oc2ccccc24)cc1
InChIInChI=1S/C48H30N2O/c1-2-10-31(11-3-1)34-22-27-45-40(28-34)41-29-42-39-14-6-9-17-47(39)51-48(42)30-46(41)50(45)36-25-20-33(21-26-36)32-18-23-35(24-19-32)49-43-15-7-4-12-37(43)38-13-5-8-16-44(38)49/h1-30H
InChIKeyUSGQKIQRKOXSCE-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

7-[4-(8-phenyldibenzofuran-2-yl)phenyl]-[1]benzofuro[2,3-b]carbazole
CID 171612092
7-phenyl-10-[4-(7-phenyl-[1]benzofuro[2,3-b]carbazol-10-yl)phenyl]-[1]benzofuro[2,3-b]carbazole
CID 134223336
3-[4-(9-dibenzofuran-3-ylcarbazol-3-yl)phenyl]-9-(4-phenylphenyl)carbazole
CID 146187490
3-dibenzofuran-3-yl-6-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole
CID 129065102
N-[4-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]-N-(4-dibenzofuran-2-ylphenyl)-4-phenylaniline
CID 118405567
7-naphthalen-2-yl-2-(9-phenylcarbazol-3-yl)-5-(4-phenylphenyl)indolo[2,3-b]carbazole;2-(9-phenylcarbazol-3-yl)-5,7-bis(4-phenylphenyl)indolo[2,3-b]carbazole;10-(9-phenylcarbazol-3-yl)-7-(4-phenylphenyl)-[1]benzofuro[2,3-b]carbazole
CID 158696933
10-dibenzofuran-3-yl-23-(4-phenylphenyl)-23-azahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(14),2,4,6,8(13),9,11,15,17,19,21,24-dodecaene
CID 121324824
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
28-(4-carbazol-9-ylphenyl)-24-phenyl-14-oxa-24-azaheptacyclo[19.11.0.02,7.08,13.015,20.023,31.025,30]dotriaconta-1(32),2,4,6,8,10,12,15,17,19,21,23(31),25(30),26,28-pentadecaene
CID 130294395
2-(5,7-diphenylindolo[2,3-b]carbazol-2-yl)-7-phenyl-[1]benzofuro[2,3-b]carbazole
CID 134223413
3-[9-(10,14-dioxapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4(9),5,7,12,15,17,19-nonaen-7-yl)carbazol-3-yl]-9-phenylcarbazole
CID 142497222
5-dibenzofuran-3-yl-7-(4-phenylphenyl)indolo[2,3-b]carbazole
CID 122594976

Frequently Asked Questions

What is the IUPAC name of 7-[4-(4-carbazol-9-ylphenyl)phenyl]-10-phenyl-[1]benzofuro[2,3-b]carbazole?
The IUPAC name of 7-[4-(4-carbazol-9-ylphenyl)phenyl]-10-phenyl-[1]benzofuro[2,3-b]carbazole (CID 167192760) is 7-[4-(4-carbazol-9-ylphenyl)phenyl]-10-phenyl-[1]benzofuro[2,3-b]carbazole.
What is the SMILES notation for 7-[4-(4-carbazol-9-ylphenyl)phenyl]-10-phenyl-[1]benzofuro[2,3-b]carbazole?
The canonical SMILES for 7-[4-(4-carbazol-9-ylphenyl)phenyl]-10-phenyl-[1]benzofuro[2,3-b]carbazole is c1ccc(-c2ccc3c(c2)c2cc4c(cc2n3-c2ccc(-c3ccc(-n5c6ccccc6c6ccccc65)cc3)cc2)oc2ccccc24)cc1.
What is the InChIKey of 7-[4-(4-carbazol-9-ylphenyl)phenyl]-10-phenyl-[1]benzofuro[2,3-b]carbazole?
The InChIKey is USGQKIQRKOXSCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H30N2O/c1-2-10-31(11-3-1)34-22-27-45-40(28-34)41-29-42-39-14-6-9-17-47(39)51-48(42)30-46(41)50(45)36-25-20-33(21-26-36)32-18-23-35(24-19-32)49-43-15-7-4-12-37(43)38-13-5-8-16-44(38)49/h1-30H.
What are the key properties of 7-[4-(4-carbazol-9-ylphenyl)phenyl]-10-phenyl-[1]benzofuro[2,3-b]carbazole?
7-[4-(4-carbazol-9-ylphenyl)phenyl]-10-phenyl-[1]benzofuro[2,3-b]carbazole 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 7-[4-(4-carbazol-9-ylphenyl)phenyl]-10-phenyl-[1]benzofuro[2,3-b]carbazole is sourced from PubChem (CID 167192760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).