4,8,14,23,27,31-hexamethyl-11,17,20,34,36,38-hexakis(4-methylphenyl)-11,17,20,34,36,38-hexaza-4,27-digermaundecacyclo[17.15.1.12,6.14,12.125,29.03,18.05,10.021,26.027,35.028,33.016,37]octatriaconta-1,3(18),5(10),6,8,12(37),13,15,19(35),21,23,25,28,30,32-pentadecaene

C78H68Ge2N6 — CID 140849542

IUPAC4,8,14,23,27,31-hexamethyl-11,17,20,34,36,38-hexakis(4-methylphenyl)-11,17,20,34,36,38-hexaza-4,27-digermaundecacyclo[17.15.1.12,6.14,12.125,29.03,18.05,10.021,26.027,35.028,33.016,37]octatriaconta-1,3(18),5(10),6,8,12(37),13,15,19(35),21,23,25,28,30,32-pentadecaene
SMILESCc1ccc(N2c3cc(C)cc4c3[Ge]3(C)c5c2cc(C)cc5N(c2ccc(C)cc2)c2c5c6c(c(c23)N4c2ccc(C)cc2)N(c2ccc(C)cc2)c2cc(C)cc3c2[Ge]6(C)c2c(cc(C)cc2N5c2ccc(C)cc2)N3c2ccc(C)cc2)cc1
InChIInChI=1S/C78H68Ge2N6/c1-45-13-25-55(26-14-45)81-61-37-51(7)41-65-69(61)79(11)70-62(81)38-52(8)42-66(70)84(58-31-19-48(4)20-32-58)76-73(79)75(83(65)57-29-17-47(3)18-30-57)77-74-78(76)86(60-35-23-50(6)24-36-60)68-44-54(10)40-64-72(68)80(74,12)71-63(82(64)56-27-15-46(2)16-28-56)39-53(9)43-67(71)85(77)59-33-21-49(5)22-34-59/h13-44H,1-12H3
InChIKeyHNIOHFNDRABJSG-UHFFFAOYSA-N
MW1234.66 g/mol
LogP17.67
Rot. Bonds6

About 4,8,14,23,27,31-hexamethyl-11,17,20,34,36,38-hexakis(4-methylphenyl)-11,17,20,34,36,38-hexaza-4,27-digermaundecacyclo[17.15.1.12,6.14,12.125,29.03,18.05,10.021,26.027,35.028,33.016,37]octatriaconta-1,3(18),5(10),6,8,12(37),13,15,19(35),21,23,25,28,30,32-pentadecaene

4,8,14,23,27,31-hexamethyl-11,17,20,34,36,38-hexakis(4-methylphenyl)-11,17,20,34,36,38-hexaza-4,27-digermaundecacyclo[17.15.1.12,6.14,12.125,29.03,18.05,10.021,26.027,35.028,33.016,37]octatriaconta-1,3(18),5(10),6,8,12(37),13,15,19(35),21,23,25,28,30,32-pentadecaene (PubChem CID 140849542) has the molecular formula C78H68Ge2N6 and a molecular weight of 1234.66 g/mol. Its IUPAC name is 4,8,14,23,27,31-hexamethyl-11,17,20,34,36,38-hexakis(4-methylphenyl)-11,17,20,34,36,38-hexaza-4,27-digermaundecacyclo[17.15.1.12,6.14,12.125,29.03,18.05,10.021,26.027,35.028,33.016,37]octatriaconta-1,3(18),5(10),6,8,12(37),13,15,19(35),21,23,25,28,30,32-pentadecaene.

Molecular Properties

Compound Name4,8,14,23,27,31-hexamethyl-11,17,20,34,36,38-hexakis(4-methylphenyl)-11,17,20,34,36,38-hexaza-4,27-digermaundecacyclo[17.15.1.12,6.14,12.125,29.03,18.05,10.021,26.027,35.028,33.016,37]octatriaconta-1,3(18),5(10),6,8,12(37),13,15,19(35),21,23,25,28,30,32-pentadecaene
PubChem CID140849542
Molecular FormulaC78H68Ge2N6
Molecular Weight1234.66 g/mol
Exact Mass1236.39
IUPAC Name4,8,14,23,27,31-hexamethyl-11,17,20,34,36,38-hexakis(4-methylphenyl)-11,17,20,34,36,38-hexaza-4,27-digermaundecacyclo[17.15.1.12,6.14,12.125,29.03,18.05,10.021,26.027,35.028,33.016,37]octatriaconta-1,3(18),5(10),6,8,12(37),13,15,19(35),21,23,25,28,30,32-pentadecaene
SMILESCc1ccc(N2c3cc(C)cc4c3[Ge]3(C)c5c2cc(C)cc5N(c2ccc(C)cc2)c2c5c6c(c(c23)N4c2ccc(C)cc2)N(c2ccc(C)cc2)c2cc(C)cc3c2[Ge]6(C)c2c(cc(C)cc2N5c2ccc(C)cc2)N3c2ccc(C)cc2)cc1
InChIInChI=1S/C78H68Ge2N6/c1-45-13-25-55(26-14-45)81-61-37-51(7)41-65-69(61)79(11)70-62(81)38-52(8)42-66(70)84(58-31-19-48(4)20-32-58)76-73(79)75(83(65)57-29-17-47(3)18-30-57)77-74-78(76)86(60-35-23-50(6)24-36-60)68-44-54(10)40-64-72(68)80(74,12)71-63(82(64)56-27-15-46(2)16-28-56)39-53(9)43-67(71)85(77)59-33-21-49(5)22-34-59/h13-44H,1-12H3
InChIKeyHNIOHFNDRABJSG-UHFFFAOYSA-N
XLogP17.67
TPSA19.44 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms86
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001234.66
LogP ≤ 517.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 4,8,14,23,27,31-hexamethyl-11,17,20,34,36,38-hexakis(4-methylphenyl)-11,17,20,34,36,38-hexaza-4,27-digermaundecacyclo[17.15.1.12,6.14,12.125,29.03,18.05,10.021,26.027,35.028,33.016,37]octatriaconta-1,3(18),5(10),6,8,12(37),13,15,19(35),21,23,25,28,30,32-pentadecaene with MolForge

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Related Compounds

1-methyl-8,14-diphenyl-22-triphenylen-2-yl-8,14,22-triaza-1-germahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene
CID 140849325
8,14,23,31-tetratert-butyl-11,17,20,34,36,38-hexakis(4-tert-butylphenyl)-4,27-bis(sulfanylidene)-11,17,20,34,36,38-hexaza-4λ5,27λ5-diphosphaundecacyclo[17.15.1.12,6.14,12.125,29.03,18.05,10.021,26.027,35.028,33.016,37]octatriaconta-1,3(18),5(10),6,8,12(37),13,15,19(35),21,23,25,28,30,32-pentadecaene;8,14,23,31-tetramethyl-11,17,20,34,36,38-hexakis(4-methylphenyl)-4,27-bis(sulfanylidene)-11,17,20,34,36,38-hexaza-4λ5,27λ5-diphosphaundecacyclo[17.15.1.12,6.14,12.125,29.03,18.05,10.021,26.027,35.028,33.016,37]octatriaconta-1,3(18),5(10),6,8,12(37),13,15,19(35),21,23,25,28,30,32-pentadecaene
CID 158340532
4,11,18-trimethyl-8,14,22-tris(4-methylphenyl)-1-phenyl-8,14,22-triaza-1-stannahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaene
CID 140848770
10-carbazol-9-yl-4,18-dimethyl-8,14-bis(4-methylphenyl)-8,14-diaza-1-borapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaene
CID 163788496
4,8,15,18,18,27,27,33,33,42,42,45-dodecamethyl-24-N,24-N,36-N,36-N-tetrakis(4-methylphenyl)-30-oxa-1,11-diaza-8-germatetradecacyclo[29.17.2.02,7.06,11.08,50.09,29.010,19.012,17.020,28.021,26.032,40.034,39.041,49.043,48]pentaconta-2(7),3,5,9,12(17),13,15,19,21(26),22,24,28,31,34(39),35,37,40,43(48),44,46,49-henicosaene-24,36-diamine
CID 140848795
4-[1,1-bis[11,18-dimethyl-8,14-bis(4-methylphenyl)-8,14-diaza-1-borapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaen-4-yl]ethyl]-11,18-dimethyl-8,14-bis(4-methylphenyl)-8,14-diaza-1-borapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaene
CID 164840926
11,16,22,30-tetrakis(4-methylphenyl)-11,16,22,30-tetraza-1,4-diboranonacyclo[15.11.1.16,26.02,15.03,12.04,27.05,10.021,29.023,28]triaconta-2(15),3(12),5,7,9,13,17,19,21(29),23(28),24,26-dodecaene
CID 174026103
2-methyl-10-(4-methylphenyl)-9,9-diphenylacridine
CID 58029188
14-(4-methylphenyl)phenanthro[9,10-b][1,4]benzoxazine
CID 154946621
10-(4-methylphenyl)-3,7-diphenylphenoxazine
CID 58556205
lithium;hydride;1,4-xylene
CID 173349078
potassium;hydride;1,4-xylene
CID 173420414

Frequently Asked Questions

What is the IUPAC name of 4,8,14,23,27,31-hexamethyl-11,17,20,34,36,38-hexakis(4-methylphenyl)-11,17,20,34,36,38-hexaza-4,27-digermaundecacyclo[17.15.1.12,6.14,12.125,29.03,18.05,10.021,26.027,35.028,33.016,37]octatriaconta-1,3(18),5(10),6,8,12(37),13,15,19(35),21,23,25,28,30,32-pentadecaene?
The IUPAC name of 4,8,14,23,27,31-hexamethyl-11,17,20,34,36,38-hexakis(4-methylphenyl)-11,17,20,34,36,38-hexaza-4,27-digermaundecacyclo[17.15.1.12,6.14,12.125,29.03,18.05,10.021,26.027,35.028,33.016,37]octatriaconta-1,3(18),5(10),6,8,12(37),13,15,19(35),21,23,25,28,30,32-pentadecaene (CID 140849542) is 4,8,14,23,27,31-hexamethyl-11,17,20,34,36,38-hexakis(4-methylphenyl)-11,17,20,34,36,38-hexaza-4,27-digermaundecacyclo[17.15.1.12,6.14,12.125,29.03,18.05,10.021,26.027,35.028,33.016,37]octatriaconta-1,3(18),5(10),6,8,12(37),13,15,19(35),21,23,25,28,30,32-pentadecaene.
What is the SMILES notation for 4,8,14,23,27,31-hexamethyl-11,17,20,34,36,38-hexakis(4-methylphenyl)-11,17,20,34,36,38-hexaza-4,27-digermaundecacyclo[17.15.1.12,6.14,12.125,29.03,18.05,10.021,26.027,35.028,33.016,37]octatriaconta-1,3(18),5(10),6,8,12(37),13,15,19(35),21,23,25,28,30,32-pentadecaene?
The canonical SMILES for 4,8,14,23,27,31-hexamethyl-11,17,20,34,36,38-hexakis(4-methylphenyl)-11,17,20,34,36,38-hexaza-4,27-digermaundecacyclo[17.15.1.12,6.14,12.125,29.03,18.05,10.021,26.027,35.028,33.016,37]octatriaconta-1,3(18),5(10),6,8,12(37),13,15,19(35),21,23,25,28,30,32-pentadecaene is Cc1ccc(N2c3cc(C)cc4c3[Ge]3(C)c5c2cc(C)cc5N(c2ccc(C)cc2)c2c5c6c(c(c23)N4c2ccc(C)cc2)N(c2ccc(C)cc2)c2cc(C)cc3c2[Ge]6(C)c2c(cc(C)cc2N5c2ccc(C)cc2)N3c2ccc(C)cc2)cc1.
What is the InChIKey of 4,8,14,23,27,31-hexamethyl-11,17,20,34,36,38-hexakis(4-methylphenyl)-11,17,20,34,36,38-hexaza-4,27-digermaundecacyclo[17.15.1.12,6.14,12.125,29.03,18.05,10.021,26.027,35.028,33.016,37]octatriaconta-1,3(18),5(10),6,8,12(37),13,15,19(35),21,23,25,28,30,32-pentadecaene?
The InChIKey is HNIOHFNDRABJSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C78H68Ge2N6/c1-45-13-25-55(26-14-45)81-61-37-51(7)41-65-69(61)79(11)70-62(81)38-52(8)42-66(70)84(58-31-19-48(4)20-32-58)76-73(79)75(83(65)57-29-17-47(3)18-30-57)77-74-78(76)86(60-35-23-50(6)24-36-60)68-44-54(10)40-64-72(68)80(74,12)71-63(82(64)56-27-15-46(2)16-28-56)39-53(9)43-67(71)85(77)59-33-21-49(5)22-34-59/h13-44H,1-12H3.
What are the key properties of 4,8,14,23,27,31-hexamethyl-11,17,20,34,36,38-hexakis(4-methylphenyl)-11,17,20,34,36,38-hexaza-4,27-digermaundecacyclo[17.15.1.12,6.14,12.125,29.03,18.05,10.021,26.027,35.028,33.016,37]octatriaconta-1,3(18),5(10),6,8,12(37),13,15,19(35),21,23,25,28,30,32-pentadecaene?
4,8,14,23,27,31-hexamethyl-11,17,20,34,36,38-hexakis(4-methylphenyl)-11,17,20,34,36,38-hexaza-4,27-digermaundecacyclo[17.15.1.12,6.14,12.125,29.03,18.05,10.021,26.027,35.028,33.016,37]octatriaconta-1,3(18),5(10),6,8,12(37),13,15,19(35),21,23,25,28,30,32-pentadecaene has a molecular weight of 1234.66 g/mol, XLogP of 17.67, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4,8,14,23,27,31-hexamethyl-11,17,20,34,36,38-hexakis(4-methylphenyl)-11,17,20,34,36,38-hexaza-4,27-digermaundecacyclo[17.15.1.12,6.14,12.125,29.03,18.05,10.021,26.027,35.028,33.016,37]octatriaconta-1,3(18),5(10),6,8,12(37),13,15,19(35),21,23,25,28,30,32-pentadecaene is sourced from PubChem (CID 140849542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).