14,29-diphenyl-33-(2-phenylcarbazol-9-yl)-13,15,29,39-tetrazanonacyclo[25.10.1.112,16.02,11.04,9.017,26.019,24.028,36.030,35]nonatriaconta-1(38),2,4,6,8,10,12(39),13,15,17,19,21,23,25,27,30(35),31,33,36-nonadecaene

C65H39N5 — CID 167023760

IUPAC14,29-diphenyl-33-(2-phenylcarbazol-9-yl)-13,15,29,39-tetrazanonacyclo[25.10.1.112,16.02,11.04,9.017,26.019,24.028,36.030,35]nonatriaconta-1(38),2,4,6,8,10,12(39),13,15,17,19,21,23,25,27,30(35),31,33,36-nonadecaene
SMILESc1ccc(-c2ccc3c4ccccc4n(-c4ccc5c(c4)c4cc6cc(c7cc8ccccc8cc7c7nc(-c8ccccc8)nc(n7)c7cc8ccccc8cc67)c4n5-c4ccccc4)c3c2)cc1
InChIInChI=1S/C65H39N5/c1-4-16-40(17-5-1)46-28-30-51-50-26-14-15-27-59(50)69(61(51)38-46)49-29-31-60-54(39-49)56-37-47-36-55(62(56)70(60)48-24-8-3-9-25-48)53-33-43-21-11-13-23-45(43)35-58(53)65-67-63(41-18-6-2-7-19-41)66-64(68-65)57-34-44-22-12-10-20-42(44)32-52(47)57/h1-39H
InChIKeyCORGGYDIWOAFQJ-UHFFFAOYSA-N
MW890.06 g/mol
LogP16.88
Rot. Bonds4

About 14,29-diphenyl-33-(2-phenylcarbazol-9-yl)-13,15,29,39-tetrazanonacyclo[25.10.1.112,16.02,11.04,9.017,26.019,24.028,36.030,35]nonatriaconta-1(38),2,4,6,8,10,12(39),13,15,17,19,21,23,25,27,30(35),31,33,36-nonadecaene

14,29-diphenyl-33-(2-phenylcarbazol-9-yl)-13,15,29,39-tetrazanonacyclo[25.10.1.112,16.02,11.04,9.017,26.019,24.028,36.030,35]nonatriaconta-1(38),2,4,6,8,10,12(39),13,15,17,19,21,23,25,27,30(35),31,33,36-nonadecaene (PubChem CID 167023760) has the molecular formula C65H39N5 and a molecular weight of 890.06 g/mol. Its IUPAC name is 14,29-diphenyl-33-(2-phenylcarbazol-9-yl)-13,15,29,39-tetrazanonacyclo[25.10.1.112,16.02,11.04,9.017,26.019,24.028,36.030,35]nonatriaconta-1(38),2,4,6,8,10,12(39),13,15,17,19,21,23,25,27,30(35),31,33,36-nonadecaene.

Molecular Properties

Compound Name14,29-diphenyl-33-(2-phenylcarbazol-9-yl)-13,15,29,39-tetrazanonacyclo[25.10.1.112,16.02,11.04,9.017,26.019,24.028,36.030,35]nonatriaconta-1(38),2,4,6,8,10,12(39),13,15,17,19,21,23,25,27,30(35),31,33,36-nonadecaene
PubChem CID167023760
Molecular FormulaC65H39N5
Molecular Weight890.06 g/mol
Exact Mass889.32
IUPAC Name14,29-diphenyl-33-(2-phenylcarbazol-9-yl)-13,15,29,39-tetrazanonacyclo[25.10.1.112,16.02,11.04,9.017,26.019,24.028,36.030,35]nonatriaconta-1(38),2,4,6,8,10,12(39),13,15,17,19,21,23,25,27,30(35),31,33,36-nonadecaene
SMILESc1ccc(-c2ccc3c4ccccc4n(-c4ccc5c(c4)c4cc6cc(c7cc8ccccc8cc7c7nc(-c8ccccc8)nc(n7)c7cc8ccccc8cc67)c4n5-c4ccccc4)c3c2)cc1
InChIInChI=1S/C65H39N5/c1-4-16-40(17-5-1)46-28-30-51-50-26-14-15-27-59(50)69(61(51)38-46)49-29-31-60-54(39-49)56-37-47-36-55(62(56)70(60)48-24-8-3-9-25-48)53-33-43-21-11-13-23-45(43)35-58(53)65-67-63(41-18-6-2-7-19-41)66-64(68-65)57-34-44-22-12-10-20-42(44)32-52(47)57/h1-39H
InChIKeyCORGGYDIWOAFQJ-UHFFFAOYSA-N
XLogP16.88
TPSA48.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms70
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500890.06
LogP ≤ 516.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 14,29-diphenyl-33-(2-phenylcarbazol-9-yl)-13,15,29,39-tetrazanonacyclo[25.10.1.112,16.02,11.04,9.017,26.019,24.028,36.030,35]nonatriaconta-1(38),2,4,6,8,10,12(39),13,15,17,19,21,23,25,27,30(35),31,33,36-nonadecaene with MolForge

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Related Compounds

25-carbazol-9-yl-10,21-diphenyl-9,11,21,31-tetrazaheptacyclo[17.10.1.18,12.02,7.013,18.020,28.022,27]hentriaconta-1(30),2,4,6,8(31),9,11,13,15,17,19,22(27),23,25,28-pentadecaene
CID 167023813
3-[9-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazol-3-yl]-9-(9-phenylcarbazol-3-yl)carbazole;3-[9-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]carbazol-3-yl]-9-(9-phenylcarbazol-3-yl)carbazole;3-[9-[11-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]carbazol-3-yl]-9-(9-phenylcarbazol-3-yl)carbazole
CID 158366423
2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9-(9-phenylcarbazol-3-yl)carbazole
CID 121475607
10,21-diphenyl-9,11,21,31-tetrazaheptacyclo[17.10.1.18,12.02,7.013,18.020,28.022,27]hentriaconta-1(30),2,4,6,8(31),9,11,13,15,17,19,22,24,26,28-pentadecaene
CID 167023752
9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3,6-bis[4-(2-phenylcarbazol-9-yl)phenyl]carbazole
CID 88878713
2-(3-carbazol-9-ylphenyl)-9-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazole
CID 145151686
9-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-(4-phenylphenyl)carbazole
CID 142377805
3-carbazol-9-yl-9-[9-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazol-3-yl]carbazole
CID 90211361
9-phenyl-2-[4-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole
CID 171438085
3,9-diphenyl-6-[6-phenyl-9-(4-phenyl-6-triphenylen-2-yl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazole;3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole
CID 158716979
3-[9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazol-2-yl]-9-triphenylen-2-ylcarbazole
CID 89423996
12-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-3-carbazol-9-yl-11-phenylindolo[2,3-a]carbazole
CID 168729522

Frequently Asked Questions

What is the IUPAC name of 14,29-diphenyl-33-(2-phenylcarbazol-9-yl)-13,15,29,39-tetrazanonacyclo[25.10.1.112,16.02,11.04,9.017,26.019,24.028,36.030,35]nonatriaconta-1(38),2,4,6,8,10,12(39),13,15,17,19,21,23,25,27,30(35),31,33,36-nonadecaene?
The IUPAC name of 14,29-diphenyl-33-(2-phenylcarbazol-9-yl)-13,15,29,39-tetrazanonacyclo[25.10.1.112,16.02,11.04,9.017,26.019,24.028,36.030,35]nonatriaconta-1(38),2,4,6,8,10,12(39),13,15,17,19,21,23,25,27,30(35),31,33,36-nonadecaene (CID 167023760) is 14,29-diphenyl-33-(2-phenylcarbazol-9-yl)-13,15,29,39-tetrazanonacyclo[25.10.1.112,16.02,11.04,9.017,26.019,24.028,36.030,35]nonatriaconta-1(38),2,4,6,8,10,12(39),13,15,17,19,21,23,25,27,30(35),31,33,36-nonadecaene.
What is the SMILES notation for 14,29-diphenyl-33-(2-phenylcarbazol-9-yl)-13,15,29,39-tetrazanonacyclo[25.10.1.112,16.02,11.04,9.017,26.019,24.028,36.030,35]nonatriaconta-1(38),2,4,6,8,10,12(39),13,15,17,19,21,23,25,27,30(35),31,33,36-nonadecaene?
The canonical SMILES for 14,29-diphenyl-33-(2-phenylcarbazol-9-yl)-13,15,29,39-tetrazanonacyclo[25.10.1.112,16.02,11.04,9.017,26.019,24.028,36.030,35]nonatriaconta-1(38),2,4,6,8,10,12(39),13,15,17,19,21,23,25,27,30(35),31,33,36-nonadecaene is c1ccc(-c2ccc3c4ccccc4n(-c4ccc5c(c4)c4cc6cc(c7cc8ccccc8cc7c7nc(-c8ccccc8)nc(n7)c7cc8ccccc8cc67)c4n5-c4ccccc4)c3c2)cc1.
What is the InChIKey of 14,29-diphenyl-33-(2-phenylcarbazol-9-yl)-13,15,29,39-tetrazanonacyclo[25.10.1.112,16.02,11.04,9.017,26.019,24.028,36.030,35]nonatriaconta-1(38),2,4,6,8,10,12(39),13,15,17,19,21,23,25,27,30(35),31,33,36-nonadecaene?
The InChIKey is CORGGYDIWOAFQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C65H39N5/c1-4-16-40(17-5-1)46-28-30-51-50-26-14-15-27-59(50)69(61(51)38-46)49-29-31-60-54(39-49)56-37-47-36-55(62(56)70(60)48-24-8-3-9-25-48)53-33-43-21-11-13-23-45(43)35-58(53)65-67-63(41-18-6-2-7-19-41)66-64(68-65)57-34-44-22-12-10-20-42(44)32-52(47)57/h1-39H.
What are the key properties of 14,29-diphenyl-33-(2-phenylcarbazol-9-yl)-13,15,29,39-tetrazanonacyclo[25.10.1.112,16.02,11.04,9.017,26.019,24.028,36.030,35]nonatriaconta-1(38),2,4,6,8,10,12(39),13,15,17,19,21,23,25,27,30(35),31,33,36-nonadecaene?
14,29-diphenyl-33-(2-phenylcarbazol-9-yl)-13,15,29,39-tetrazanonacyclo[25.10.1.112,16.02,11.04,9.017,26.019,24.028,36.030,35]nonatriaconta-1(38),2,4,6,8,10,12(39),13,15,17,19,21,23,25,27,30(35),31,33,36-nonadecaene has a molecular weight of 890.06 g/mol, XLogP of 16.88, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 14,29-diphenyl-33-(2-phenylcarbazol-9-yl)-13,15,29,39-tetrazanonacyclo[25.10.1.112,16.02,11.04,9.017,26.019,24.028,36.030,35]nonatriaconta-1(38),2,4,6,8,10,12(39),13,15,17,19,21,23,25,27,30(35),31,33,36-nonadecaene is sourced from PubChem (CID 167023760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).