8-[2-[7-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]naphthalen-2-yl]carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine;8-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-5-phenylpyrimido[5,4-b]indole;4-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene

C182H113N15OS — CID 159831238

IUPAC8-[2-[7-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]naphthalen-2-yl]carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine;8-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-5-phenylpyrimido[5,4-b]indole;4-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6ccc(-c7ccc8c9ccccc9n(-c9ccc%10oc%11ccncc%11c%10c9)c8c7)cc6c5)ccc43)c2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5cccc(-c6ccc7c8ccccc8n(-c8ccc9c(c8)c8ncncc8n9-c8ccccc8)c7c6)c5)ccc43)c2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5cccc(-c6ccc7c8ccccc8n(-c8ccc9sc%10cccnc%10c9n8)c7c6)c5)ccc43)c2)cc1
InChIInChI=1S/C63H40N6.C62H38N4O.C57H35N5S/c1-4-15-41(16-5-1)47-35-55(42-17-6-2-7-18-42)66-62(37-47)69-57-26-13-11-24-51(57)53-34-45(28-31-58(53)69)43-19-14-20-44(33-43)46-27-30-52-50-23-10-12-25-56(50)68(60(52)36-46)49-29-32-59-54(38-49)63-61(39-64-40-65-63)67(59)48-21-8-3-9-22-48;1-3-11-39(12-4-1)47-34-55(41-13-5-2-6-14-41)64-62(36-47)66-57-18-10-8-16-50(57)52-33-44(24-27-58(52)66)42-21-19-40-20-22-43(32-46(40)31-42)45-23-26-51-49-15-7-9-17-56(49)65(59(51)35-45)48-25-28-60-53(37-48)54-38-63-30-29-61(54)67-60;1-3-13-36(14-4-1)42-33-47(37-15-5-2-6-16-37)59-55(35-42)61-49-22-10-8-20-44(49)46-32-40(25-27-50(46)61)38-17-11-18-39(31-38)41-24-26-45-43-19-7-9-21-48(43)62(51(45)34-41)54-29-28-53-57(60-54)56-52(63-53)23-12-30-58-56/h1-40H;1-38H;1-35H
InChIKeyNNMIORMCYNWLBP-UHFFFAOYSA-N
MW2558.08 g/mol
LogP47.32
Rot. Bonds19

About 8-[2-[7-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]naphthalen-2-yl]carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine;8-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-5-phenylpyrimido[5,4-b]indole;4-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene

8-[2-[7-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]naphthalen-2-yl]carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine;8-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-5-phenylpyrimido[5,4-b]indole;4-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene (PubChem CID 159831238) has the molecular formula C182H113N15OS and a molecular weight of 2558.08 g/mol. Its IUPAC name is 8-[2-[7-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]naphthalen-2-yl]carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine;8-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-5-phenylpyrimido[5,4-b]indole;4-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene.

Molecular Properties

Compound Name8-[2-[7-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]naphthalen-2-yl]carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine;8-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-5-phenylpyrimido[5,4-b]indole;4-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
PubChem CID159831238
Molecular FormulaC182H113N15OS
Molecular Weight2558.08 g/mol
Exact Mass2555.90
IUPAC Name8-[2-[7-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]naphthalen-2-yl]carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine;8-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-5-phenylpyrimido[5,4-b]indole;4-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6ccc(-c7ccc8c9ccccc9n(-c9ccc%10oc%11ccncc%11c%10c9)c8c7)cc6c5)ccc43)c2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5cccc(-c6ccc7c8ccccc8n(-c8ccc9c(c8)c8ncncc8n9-c8ccccc8)c7c6)c5)ccc43)c2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5cccc(-c6ccc7c8ccccc8n(-c8ccc9sc%10cccnc%10c9n8)c7c6)c5)ccc43)c2)cc1
InChIInChI=1S/C63H40N6.C62H38N4O.C57H35N5S/c1-4-15-41(16-5-1)47-35-55(42-17-6-2-7-18-42)66-62(37-47)69-57-26-13-11-24-51(57)53-34-45(28-31-58(53)69)43-19-14-20-44(33-43)46-27-30-52-50-23-10-12-25-56(50)68(60(52)36-46)49-29-32-59-54(38-49)63-61(39-64-40-65-63)67(59)48-21-8-3-9-22-48;1-3-11-39(12-4-1)47-34-55(41-13-5-2-6-14-41)64-62(36-47)66-57-18-10-8-16-50(57)52-33-44(24-27-58(52)66)42-21-19-40-20-22-43(32-46(40)31-42)45-23-26-51-49-15-7-9-17-56(49)65(59(51)35-45)48-25-28-60-53(37-48)54-38-63-30-29-61(54)67-60;1-3-13-36(14-4-1)42-33-47(37-15-5-2-6-16-37)59-55(35-42)61-49-22-10-8-20-44(49)46-32-40(25-27-50(46)61)38-17-11-18-39(31-38)41-24-26-45-43-19-7-9-21-48(43)62(51(45)34-41)54-29-28-53-57(60-54)56-52(63-53)23-12-30-58-56/h1-40H;1-38H;1-35H
InChIKeyNNMIORMCYNWLBP-UHFFFAOYSA-N
XLogP47.32
TPSA150.77 Ų
H-Bond Donors
H-Bond Acceptors17
Rotatable Bonds19
Heavy Atoms199
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002558.08
LogP ≤ 547.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1017

Analyze 8-[2-[7-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]naphthalen-2-yl]carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine;8-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-5-phenylpyrimido[5,4-b]indole;4-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene with MolForge

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Frequently Asked Questions

What is the IUPAC name of 8-[2-[7-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]naphthalen-2-yl]carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine;8-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-5-phenylpyrimido[5,4-b]indole;4-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene?
The IUPAC name of 8-[2-[7-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]naphthalen-2-yl]carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine;8-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-5-phenylpyrimido[5,4-b]indole;4-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene (CID 159831238) is 8-[2-[7-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]naphthalen-2-yl]carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine;8-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-5-phenylpyrimido[5,4-b]indole;4-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene.
What is the SMILES notation for 8-[2-[7-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]naphthalen-2-yl]carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine;8-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-5-phenylpyrimido[5,4-b]indole;4-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene?
The canonical SMILES for 8-[2-[7-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]naphthalen-2-yl]carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine;8-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-5-phenylpyrimido[5,4-b]indole;4-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene is c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6ccc(-c7ccc8c9ccccc9n(-c9ccc%10oc%11ccncc%11c%10c9)c8c7)cc6c5)ccc43)c2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5cccc(-c6ccc7c8ccccc8n(-c8ccc9c(c8)c8ncncc8n9-c8ccccc8)c7c6)c5)ccc43)c2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5cccc(-c6ccc7c8ccccc8n(-c8ccc9sc%10cccnc%10c9n8)c7c6)c5)ccc43)c2)cc1.
What is the InChIKey of 8-[2-[7-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]naphthalen-2-yl]carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine;8-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-5-phenylpyrimido[5,4-b]indole;4-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene?
The InChIKey is NNMIORMCYNWLBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C63H40N6.C62H38N4O.C57H35N5S/c1-4-15-41(16-5-1)47-35-55(42-17-6-2-7-18-42)66-62(37-47)69-57-26-13-11-24-51(57)53-34-45(28-31-58(53)69)43-19-14-20-44(33-43)46-27-30-52-50-23-10-12-25-56(50)68(60(52)36-46)49-29-32-59-54(38-49)63-61(39-64-40-65-63)67(59)48-21-8-3-9-22-48;1-3-11-39(12-4-1)47-34-55(41-13-5-2-6-14-41)64-62(36-47)66-57-18-10-8-16-50(57)52-33-44(24-27-58(52)66)42-21-19-40-20-22-43(32-46(40)31-42)45-23-26-51-49-15-7-9-17-56(49)65(59(51)35-45)48-25-28-60-53(37-48)54-38-63-30-29-61(54)67-60;1-3-13-36(14-4-1)42-33-47(37-15-5-2-6-16-37)59-55(35-42)61-49-22-10-8-20-44(49)46-32-40(25-27-50(46)61)38-17-11-18-39(31-38)41-24-26-45-43-19-7-9-21-48(43)62(51(45)34-41)54-29-28-53-57(60-54)56-52(63-53)23-12-30-58-56/h1-40H;1-38H;1-35H.
What are the key properties of 8-[2-[7-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]naphthalen-2-yl]carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine;8-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-5-phenylpyrimido[5,4-b]indole;4-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene?
8-[2-[7-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]naphthalen-2-yl]carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine;8-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-5-phenylpyrimido[5,4-b]indole;4-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene has a molecular weight of 2558.08 g/mol, XLogP of 47.32, 19 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[2-[7-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]naphthalen-2-yl]carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine;8-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-5-phenylpyrimido[5,4-b]indole;4-[2-[3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]phenyl]carbazol-9-yl]-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene is sourced from PubChem (CID 159831238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).