7-[4-[2,6-bis[4-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]carbazole;11-[3-[2,4-bis[3-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]quinazolin-6-yl]phenyl]-[1]benzofuro[3,2-b]carbazole

C156H88N10O6 — CID 159872734

IUPAC7-[4-[2,6-bis[4-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]carbazole;11-[3-[2,4-bis[3-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]quinazolin-6-yl]phenyl]-[1]benzofuro[3,2-b]carbazole
SMILESc1cc(-c2ccc3nc(-c4cccc(-n5c6ccccc6c6cc7oc8ccccc8c7cc65)c4)nc(-c4cccc(-n5c6ccccc6c6cc7oc8ccccc8c7cc65)c4)c3c2)cc(-n2c3ccccc3c3cc4oc5ccccc5c4cc32)c1.c1ccc2c(c1)oc1cc3c(cc12)c1ccccc1n3-c1ccc(-c2cc(-c3ccc(-n4c5ccccc5c5cc6c(cc54)oc4ccccc46)cc3)nc(-c3ccc(-n4c5ccccc5c5cc6c(cc54)oc4ccccc46)cc3)n2)cc1
InChIInChI=1S/C80H45N5O3.C76H43N5O3/c1-7-28-67-53(22-1)59-43-76-62(56-25-4-10-31-73(56)86-76)40-70(59)83(67)50-19-13-16-46(36-50)47-34-35-66-65(39-47)79(48-17-14-20-51(37-48)84-68-29-8-2-23-54(68)60-44-77-63(41-71(60)84)57-26-5-11-32-74(57)87-77)82-80(81-66)49-18-15-21-52(38-49)85-69-30-9-3-24-55(69)61-45-78-64(42-72(61)85)58-27-6-12-33-75(58)88-78;1-7-19-64-50(13-1)56-37-59-53-16-4-10-22-70(53)82-73(59)41-67(56)79(64)47-31-25-44(26-32-47)62-40-63(45-27-33-48(34-28-45)80-65-20-8-2-14-51(65)57-38-60-54-17-5-11-23-71(54)83-74(60)42-68(57)80)78-76(77-62)46-29-35-49(36-30-46)81-66-21-9-3-15-52(66)58-39-61-55-18-6-12-24-72(55)84-75(61)43-69(58)81/h1-45H;1-43H
InChIKeyNSNCBSQQXAAXGD-UHFFFAOYSA-N
MW2198.48 g/mol
LogP42.09
Rot. Bonds12

About 7-[4-[2,6-bis[4-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]carbazole;11-[3-[2,4-bis[3-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]quinazolin-6-yl]phenyl]-[1]benzofuro[3,2-b]carbazole

7-[4-[2,6-bis[4-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]carbazole;11-[3-[2,4-bis[3-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]quinazolin-6-yl]phenyl]-[1]benzofuro[3,2-b]carbazole (PubChem CID 159872734) has the molecular formula C156H88N10O6 and a molecular weight of 2198.48 g/mol. Its IUPAC name is 7-[4-[2,6-bis[4-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]carbazole;11-[3-[2,4-bis[3-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]quinazolin-6-yl]phenyl]-[1]benzofuro[3,2-b]carbazole.

Molecular Properties

Compound Name7-[4-[2,6-bis[4-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]carbazole;11-[3-[2,4-bis[3-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]quinazolin-6-yl]phenyl]-[1]benzofuro[3,2-b]carbazole
PubChem CID159872734
Molecular FormulaC156H88N10O6
Molecular Weight2198.48 g/mol
Exact Mass2196.69
IUPAC Name7-[4-[2,6-bis[4-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]carbazole;11-[3-[2,4-bis[3-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]quinazolin-6-yl]phenyl]-[1]benzofuro[3,2-b]carbazole
SMILESc1cc(-c2ccc3nc(-c4cccc(-n5c6ccccc6c6cc7oc8ccccc8c7cc65)c4)nc(-c4cccc(-n5c6ccccc6c6cc7oc8ccccc8c7cc65)c4)c3c2)cc(-n2c3ccccc3c3cc4oc5ccccc5c4cc32)c1.c1ccc2c(c1)oc1cc3c(cc12)c1ccccc1n3-c1ccc(-c2cc(-c3ccc(-n4c5ccccc5c5cc6c(cc54)oc4ccccc46)cc3)nc(-c3ccc(-n4c5ccccc5c5cc6c(cc54)oc4ccccc46)cc3)n2)cc1
InChIInChI=1S/C80H45N5O3.C76H43N5O3/c1-7-28-67-53(22-1)59-43-76-62(56-25-4-10-31-73(56)86-76)40-70(59)83(67)50-19-13-16-46(36-50)47-34-35-66-65(39-47)79(48-17-14-20-51(37-48)84-68-29-8-2-23-54(68)60-44-77-63(41-71(60)84)57-26-5-11-32-74(57)87-77)82-80(81-66)49-18-15-21-52(38-49)85-69-30-9-3-24-55(69)61-45-78-64(42-72(61)85)58-27-6-12-33-75(58)88-78;1-7-19-64-50(13-1)56-37-59-53-16-4-10-22-70(53)82-73(59)41-67(56)79(64)47-31-25-44(26-32-47)62-40-63(45-27-33-48(34-28-45)80-65-20-8-2-14-51(65)57-38-60-54-17-5-11-23-71(54)83-74(60)42-68(57)80)78-76(77-62)46-29-35-49(36-30-46)81-66-21-9-3-15-52(66)58-39-61-55-18-6-12-24-72(55)84-75(61)43-69(58)81/h1-45H;1-43H
InChIKeyNSNCBSQQXAAXGD-UHFFFAOYSA-N
XLogP42.09
TPSA159.98 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds12
Heavy Atoms172
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002198.48
LogP ≤ 542.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Analyze 7-[4-[2,6-bis[4-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]carbazole;11-[3-[2,4-bis[3-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]quinazolin-6-yl]phenyl]-[1]benzofuro[3,2-b]carbazole with MolForge

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Related Compounds

11-[3-[4-[3-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]-6-[4-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]quinazolin-2-yl]phenyl]-[1]benzofuro[3,2-b]carbazole
CID 126630945
11-[4-[2-[3-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]-4-[4-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]quinazolin-6-yl]phenyl]-[1]benzofuro[3,2-b]carbazole
CID 126630887
3-dibenzofuran-3-yl-9-[3-[6-[3-(3-dibenzofuran-3-ylcarbazol-9-yl)phenyl]-4-[4-[4-(3-dibenzofuran-3-ylcarbazol-9-yl)phenyl]phenyl]quinazolin-2-yl]phenyl]carbazole
CID 126631957
11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzofuro[3,2-b]carbazole
CID 126580313
25-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-15-phenyl-11-oxa-15,25-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17,19,21,23,26-dodecaene
CID 140957385
2-dibenzofuran-3-yl-9-[3-[4-[6-(2-dibenzofuran-3-ylcarbazol-9-yl)naphthalen-2-yl]-6-[3-(2-dibenzofuran-3-ylcarbazol-9-yl)phenyl]quinazolin-2-yl]phenyl]carbazole
CID 126631881
3-dibenzofuran-3-yl-9-[4-[4-[4-(3-dibenzofuran-3-ylcarbazol-9-yl)phenyl]-6-[4-[4-(3-dibenzofuran-3-ylcarbazol-9-yl)phenyl]phenyl]pyrimidin-2-yl]phenyl]carbazole;3-dibenzofuran-3-yl-9-[3-[4-[3-(3-dibenzofuran-3-ylcarbazol-9-yl)phenyl]-6-[4-(3-dibenzofuran-3-ylcarbazol-9-yl)phenyl]pyrimidin-2-yl]phenyl]carbazole;3-dibenzofuran-3-yl-9-[4-[2-[3-(3-dibenzofuran-3-ylcarbazol-9-yl)phenyl]-6-[4-(3-dibenzofuran-3-ylcarbazol-9-yl)phenyl]pyrimidin-4-yl]phenyl]carbazole
CID 158701376
3-dibenzofuran-2-yl-9-[4-[4-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)phenyl]-6-[4-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)phenyl]phenyl]quinazolin-2-yl]phenyl]carbazole
CID 126632019
9-[3-[2,6-bis[4-[2,7-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]quinazolin-4-yl]phenyl]-2,7-bis(9-phenylcarbazol-3-yl)carbazole;9-[4-[2,4-bis[3-[2,7-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]quinazolin-6-yl]phenyl]-2,7-bis(9-phenylcarbazol-3-yl)carbazole
CID 160941783
3-dibenzofuran-3-yl-9-[3-[6-[3-(3-dibenzofuran-3-ylcarbazol-9-yl)phenyl]-2-[4-[4-(3-dibenzofuran-3-ylcarbazol-9-yl)phenyl]phenyl]pyrimidin-4-yl]phenyl]carbazole;3-dibenzofuran-3-yl-9-[3-[6-[3-(3-dibenzofuran-3-ylcarbazol-9-yl)phenyl]-2-[4-(3-dibenzofuran-3-ylcarbazol-9-yl)phenyl]pyrimidin-4-yl]phenyl]carbazole
CID 158922276
9-[4-[2,4-bis[4-(3-dibenzofuran-3-ylcarbazol-9-yl)phenyl]quinazolin-6-yl]phenyl]-3-dibenzofuran-3-ylcarbazole
CID 126631950
2-dibenzofuran-3-yl-9-[4-[4-[4-(2-dibenzofuran-3-ylcarbazol-9-yl)phenyl]-6-[4-[4-(2-dibenzofuran-3-ylcarbazol-9-yl)phenyl]phenyl]quinazolin-2-yl]phenyl]carbazole
CID 126631899

Frequently Asked Questions

What is the IUPAC name of 7-[4-[2,6-bis[4-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]carbazole;11-[3-[2,4-bis[3-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]quinazolin-6-yl]phenyl]-[1]benzofuro[3,2-b]carbazole?
The IUPAC name of 7-[4-[2,6-bis[4-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]carbazole;11-[3-[2,4-bis[3-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]quinazolin-6-yl]phenyl]-[1]benzofuro[3,2-b]carbazole (CID 159872734) is 7-[4-[2,6-bis[4-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]carbazole;11-[3-[2,4-bis[3-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]quinazolin-6-yl]phenyl]-[1]benzofuro[3,2-b]carbazole.
What is the SMILES notation for 7-[4-[2,6-bis[4-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]carbazole;11-[3-[2,4-bis[3-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]quinazolin-6-yl]phenyl]-[1]benzofuro[3,2-b]carbazole?
The canonical SMILES for 7-[4-[2,6-bis[4-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]carbazole;11-[3-[2,4-bis[3-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]quinazolin-6-yl]phenyl]-[1]benzofuro[3,2-b]carbazole is c1cc(-c2ccc3nc(-c4cccc(-n5c6ccccc6c6cc7oc8ccccc8c7cc65)c4)nc(-c4cccc(-n5c6ccccc6c6cc7oc8ccccc8c7cc65)c4)c3c2)cc(-n2c3ccccc3c3cc4oc5ccccc5c4cc32)c1.c1ccc2c(c1)oc1cc3c(cc12)c1ccccc1n3-c1ccc(-c2cc(-c3ccc(-n4c5ccccc5c5cc6c(cc54)oc4ccccc46)cc3)nc(-c3ccc(-n4c5ccccc5c5cc6c(cc54)oc4ccccc46)cc3)n2)cc1.
What is the InChIKey of 7-[4-[2,6-bis[4-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]carbazole;11-[3-[2,4-bis[3-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]quinazolin-6-yl]phenyl]-[1]benzofuro[3,2-b]carbazole?
The InChIKey is NSNCBSQQXAAXGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C80H45N5O3.C76H43N5O3/c1-7-28-67-53(22-1)59-43-76-62(56-25-4-10-31-73(56)86-76)40-70(59)83(67)50-19-13-16-46(36-50)47-34-35-66-65(39-47)79(48-17-14-20-51(37-48)84-68-29-8-2-23-54(68)60-44-77-63(41-71(60)84)57-26-5-11-32-74(57)87-77)82-80(81-66)49-18-15-21-52(38-49)85-69-30-9-3-24-55(69)61-45-78-64(42-72(61)85)58-27-6-12-33-75(58)88-78;1-7-19-64-50(13-1)56-37-59-53-16-4-10-22-70(53)82-73(59)41-67(56)79(64)47-31-25-44(26-32-47)62-40-63(45-27-33-48(34-28-45)80-65-20-8-2-14-51(65)57-38-60-54-17-5-11-23-71(54)83-74(60)42-68(57)80)78-76(77-62)46-29-35-49(36-30-46)81-66-21-9-3-15-52(66)58-39-61-55-18-6-12-24-72(55)84-75(61)43-69(58)81/h1-45H;1-43H.
What are the key properties of 7-[4-[2,6-bis[4-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]carbazole;11-[3-[2,4-bis[3-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]quinazolin-6-yl]phenyl]-[1]benzofuro[3,2-b]carbazole?
7-[4-[2,6-bis[4-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]carbazole;11-[3-[2,4-bis[3-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]quinazolin-6-yl]phenyl]-[1]benzofuro[3,2-b]carbazole has a molecular weight of 2198.48 g/mol, XLogP of 42.09, 12 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[4-[2,6-bis[4-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]carbazole;11-[3-[2,4-bis[3-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]quinazolin-6-yl]phenyl]-[1]benzofuro[3,2-b]carbazole is sourced from PubChem (CID 159872734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).