9-[7-[7-[7-(7-carbazol-9-yldibenzofuran-3-yl)dibenzofuran-3-yl]dibenzofuran-3-yl]dibenzofuran-3-yl]carbazole

C72H40N2O4 — CID 90207091

IUPAC9-[7-[7-[7-(7-carbazol-9-yldibenzofuran-3-yl)dibenzofuran-3-yl]dibenzofuran-3-yl]dibenzofuran-3-yl]carbazole
SMILESc1ccc2c(c1)c1ccccc1n2-c1ccc2c(c1)oc1cc(-c3ccc4c(c3)oc3cc(-c5ccc6c(c5)oc5cc(-c7ccc8c(c7)oc7cc(-n9c%10ccccc%10c%10ccccc%109)ccc78)ccc56)ccc34)ccc12
InChIInChI=1S/C72H40N2O4/c1-5-13-61-49(9-1)50-10-2-6-14-62(50)73(61)47-23-31-59-57-29-21-45(37-69(57)77-71(59)39-47)43-19-27-55-53-25-17-41(33-65(53)75-67(55)35-43)42-18-26-54-56-28-20-44(36-68(56)76-66(54)34-42)46-22-30-58-60-32-24-48(40-72(60)78-70(58)38-46)74-63-15-7-3-11-51(63)52-12-4-8-16-64(52)74/h1-40H
InChIKeyCWNPQGXELRHKMA-UHFFFAOYSA-N
MW997.12 g/mol
LogP20.48
Rot. Bonds5

About 9-[7-[7-[7-(7-carbazol-9-yldibenzofuran-3-yl)dibenzofuran-3-yl]dibenzofuran-3-yl]dibenzofuran-3-yl]carbazole

9-[7-[7-[7-(7-carbazol-9-yldibenzofuran-3-yl)dibenzofuran-3-yl]dibenzofuran-3-yl]dibenzofuran-3-yl]carbazole (PubChem CID 90207091) has the molecular formula C72H40N2O4 and a molecular weight of 997.12 g/mol. Its IUPAC name is 9-[7-[7-[7-(7-carbazol-9-yldibenzofuran-3-yl)dibenzofuran-3-yl]dibenzofuran-3-yl]dibenzofuran-3-yl]carbazole.

Molecular Properties

Compound Name9-[7-[7-[7-(7-carbazol-9-yldibenzofuran-3-yl)dibenzofuran-3-yl]dibenzofuran-3-yl]dibenzofuran-3-yl]carbazole
PubChem CID90207091
Molecular FormulaC72H40N2O4
Molecular Weight997.12 g/mol
Exact Mass996.30
IUPAC Name9-[7-[7-[7-(7-carbazol-9-yldibenzofuran-3-yl)dibenzofuran-3-yl]dibenzofuran-3-yl]dibenzofuran-3-yl]carbazole
SMILESc1ccc2c(c1)c1ccccc1n2-c1ccc2c(c1)oc1cc(-c3ccc4c(c3)oc3cc(-c5ccc6c(c5)oc5cc(-c7ccc8c(c7)oc7cc(-n9c%10ccccc%10c%10ccccc%109)ccc78)ccc56)ccc34)ccc12
InChIInChI=1S/C72H40N2O4/c1-5-13-61-49(9-1)50-10-2-6-14-62(50)73(61)47-23-31-59-57-29-21-45(37-69(57)77-71(59)39-47)43-19-27-55-53-25-17-41(33-65(53)75-67(55)35-43)42-18-26-54-56-28-20-44(36-68(56)76-66(54)34-42)46-22-30-58-60-32-24-48(40-72(60)78-70(58)38-46)74-63-15-7-3-11-51(63)52-12-4-8-16-64(52)74/h1-40H
InChIKeyCWNPQGXELRHKMA-UHFFFAOYSA-N
XLogP20.48
TPSA62.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms78
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500997.12
LogP ≤ 520.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 9-[7-[7-[7-(7-carbazol-9-yldibenzofuran-3-yl)dibenzofuran-3-yl]dibenzofuran-3-yl]dibenzofuran-3-yl]carbazole with MolForge

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Related Compounds

9-(17-carbazol-9-yl-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1(13),2,4(9),5,7,11,14(19),15,17-nonaen-7-yl)carbazole
CID 59147323
3-dibenzofuran-2-yl-9-dibenzofuran-3-ylcarbazole
CID 118504725
3-carbazol-9-yl-9-(7-carbazol-9-yldibenzofuran-3-yl)carbazole
CID 123285372
3,6-bis(9-dibenzofuran-3-ylcarbazol-3-yl)-9-phenylcarbazole
CID 88594553
9-[7-(7-methyldibenzofuran-2-yl)dibenzofuran-3-yl]carbazole
CID 170079327
9-[7-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-3-yl]carbazole
CID 146335707
3-[4-(9-dibenzofuran-3-ylcarbazol-3-yl)phenyl]-9-(4-phenylphenyl)carbazole
CID 146187490
9-phenyl-3-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]carbazole
CID 118565554
2-[9-[4-[4-(4-dibenzofuran-3-ylphenyl)phenyl]phenyl]carbazol-2-yl]-9-phenylcarbazole
CID 170386572
3-(9-dibenzofuran-3-ylcarbazol-2-yl)-9-phenylcarbazole
CID 70658931
9-(7-dibenzofuran-3-yldibenzofuran-3-yl)-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 170285118
3-phenyl-9-(7-phenyldibenzofuran-2-yl)carbazole
CID 170286211

Frequently Asked Questions

What is the IUPAC name of 9-[7-[7-[7-(7-carbazol-9-yldibenzofuran-3-yl)dibenzofuran-3-yl]dibenzofuran-3-yl]dibenzofuran-3-yl]carbazole?
The IUPAC name of 9-[7-[7-[7-(7-carbazol-9-yldibenzofuran-3-yl)dibenzofuran-3-yl]dibenzofuran-3-yl]dibenzofuran-3-yl]carbazole (CID 90207091) is 9-[7-[7-[7-(7-carbazol-9-yldibenzofuran-3-yl)dibenzofuran-3-yl]dibenzofuran-3-yl]dibenzofuran-3-yl]carbazole.
What is the SMILES notation for 9-[7-[7-[7-(7-carbazol-9-yldibenzofuran-3-yl)dibenzofuran-3-yl]dibenzofuran-3-yl]dibenzofuran-3-yl]carbazole?
The canonical SMILES for 9-[7-[7-[7-(7-carbazol-9-yldibenzofuran-3-yl)dibenzofuran-3-yl]dibenzofuran-3-yl]dibenzofuran-3-yl]carbazole is c1ccc2c(c1)c1ccccc1n2-c1ccc2c(c1)oc1cc(-c3ccc4c(c3)oc3cc(-c5ccc6c(c5)oc5cc(-c7ccc8c(c7)oc7cc(-n9c%10ccccc%10c%10ccccc%109)ccc78)ccc56)ccc34)ccc12.
What is the InChIKey of 9-[7-[7-[7-(7-carbazol-9-yldibenzofuran-3-yl)dibenzofuran-3-yl]dibenzofuran-3-yl]dibenzofuran-3-yl]carbazole?
The InChIKey is CWNPQGXELRHKMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C72H40N2O4/c1-5-13-61-49(9-1)50-10-2-6-14-62(50)73(61)47-23-31-59-57-29-21-45(37-69(57)77-71(59)39-47)43-19-27-55-53-25-17-41(33-65(53)75-67(55)35-43)42-18-26-54-56-28-20-44(36-68(56)76-66(54)34-42)46-22-30-58-60-32-24-48(40-72(60)78-70(58)38-46)74-63-15-7-3-11-51(63)52-12-4-8-16-64(52)74/h1-40H.
What are the key properties of 9-[7-[7-[7-(7-carbazol-9-yldibenzofuran-3-yl)dibenzofuran-3-yl]dibenzofuran-3-yl]dibenzofuran-3-yl]carbazole?
9-[7-[7-[7-(7-carbazol-9-yldibenzofuran-3-yl)dibenzofuran-3-yl]dibenzofuran-3-yl]dibenzofuran-3-yl]carbazole has a molecular weight of 997.12 g/mol, XLogP of 20.48, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[7-[7-[7-(7-carbazol-9-yldibenzofuran-3-yl)dibenzofuran-3-yl]dibenzofuran-3-yl]dibenzofuran-3-yl]carbazole is sourced from PubChem (CID 90207091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).