19-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-4-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5,7,9,12,17,20,22,24,26-dodecaene;8-dibenzofuran-2-yl-4-(2,5-diphenyl-1,2,4-triazol-3-yl)-19-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5(10),6,8,12,17,20,22,24,26-dodecaene;14-(3,5-dimethylphenyl)-29-(2,4-diphenylpyrimidin-5-yl)-18-thia-14,29-diazaoctacyclo[15.14.0.03,15.04,13.07,12.019,31.022,30.023,28]hentriaconta-1(17),2,4(13),5,7,9,11,15,19(31),20,22(30),23,25,27-tetradecaene

C165H102N14OS3 — CID 157184092

IUPAC19-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-4-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5,7,9,12,17,20,22,24,26-dodecaene;8-dibenzofuran-2-yl-4-(2,5-diphenyl-1,2,4-triazol-3-yl)-19-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5(10),6,8,12,17,20,22,24,26-dodecaene;14-(3,5-dimethylphenyl)-29-(2,4-diphenylpyrimidin-5-yl)-18-thia-14,29-diazaoctacyclo[15.14.0.03,15.04,13.07,12.019,31.022,30.023,28]hentriaconta-1(17),2,4(13),5,7,9,11,15,19(31),20,22(30),23,25,27-tetradecaene
SMILESCc1cc(C)cc(-n2c3cc4sc5ccc6c7ccccc7n(-c7cnc(-c8ccccc8)nc7-c7ccccc7)c6c5c4cc3c3ccc4ccccc4c32)c1.c1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-n4c5ccccc5c5cc6c(cc54)sc4ccc5c7ccccc7n(-c7ccccc7)c5c46)n3)cc2)cc1.c1ccc(-c2nc(-n3c4ccc(-c5ccc6oc7ccccc7c6c5)cc4c4ccc5sc6cc7c(cc6c5c43)c3ccccc3n7-c3ccccc3)n(-c3ccccc3)n2)cc1
InChIInChI=1S/C57H35N5S.C56H33N5OS.C52H34N4S/c1-4-14-36(15-5-1)38-24-28-40(29-25-38)55-58-56(41-30-26-39(27-31-41)37-16-6-2-7-17-37)60-57(59-55)62-49-23-13-11-21-44(49)46-34-47-52(35-50(46)62)63-51-33-32-45-43-20-10-12-22-48(43)61(54(45)53(47)51)42-18-8-3-9-19-42;1-4-14-34(15-5-1)55-57-56(61(58-55)38-18-8-3-9-19-38)60-47-27-24-35(36-25-28-50-44(31-36)40-21-11-13-23-49(40)62-50)30-42(47)41-26-29-51-53(54(41)60)45-32-43-39-20-10-12-22-46(39)59(37-16-6-2-7-17-37)48(43)33-52(45)63-51;1-31-25-32(2)27-36(26-31)55-44-29-47-42(28-41(44)40-22-21-33-13-9-10-18-37(33)50(40)55)48-46(57-47)24-23-39-38-19-11-12-20-43(38)56(51(39)48)45-30-53-52(35-16-7-4-8-17-35)54-49(45)34-14-5-3-6-15-34/h1-35H;1-33H;3-30H,1-2H3
InChIKeyAOXHGYIPKUKNPB-UHFFFAOYSA-N
MW2392.93 g/mol
LogP44.31
Rot. Bonds15

About 19-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-4-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5,7,9,12,17,20,22,24,26-dodecaene;8-dibenzofuran-2-yl-4-(2,5-diphenyl-1,2,4-triazol-3-yl)-19-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5(10),6,8,12,17,20,22,24,26-dodecaene;14-(3,5-dimethylphenyl)-29-(2,4-diphenylpyrimidin-5-yl)-18-thia-14,29-diazaoctacyclo[15.14.0.03,15.04,13.07,12.019,31.022,30.023,28]hentriaconta-1(17),2,4(13),5,7,9,11,15,19(31),20,22(30),23,25,27-tetradecaene

19-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-4-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5,7,9,12,17,20,22,24,26-dodecaene;8-dibenzofuran-2-yl-4-(2,5-diphenyl-1,2,4-triazol-3-yl)-19-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5(10),6,8,12,17,20,22,24,26-dodecaene;14-(3,5-dimethylphenyl)-29-(2,4-diphenylpyrimidin-5-yl)-18-thia-14,29-diazaoctacyclo[15.14.0.03,15.04,13.07,12.019,31.022,30.023,28]hentriaconta-1(17),2,4(13),5,7,9,11,15,19(31),20,22(30),23,25,27-tetradecaene (PubChem CID 157184092) has the molecular formula C165H102N14OS3 and a molecular weight of 2392.93 g/mol. Its IUPAC name is 19-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-4-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5,7,9,12,17,20,22,24,26-dodecaene;8-dibenzofuran-2-yl-4-(2,5-diphenyl-1,2,4-triazol-3-yl)-19-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5(10),6,8,12,17,20,22,24,26-dodecaene;14-(3,5-dimethylphenyl)-29-(2,4-diphenylpyrimidin-5-yl)-18-thia-14,29-diazaoctacyclo[15.14.0.03,15.04,13.07,12.019,31.022,30.023,28]hentriaconta-1(17),2,4(13),5,7,9,11,15,19(31),20,22(30),23,25,27-tetradecaene.

Molecular Properties

Compound Name19-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-4-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5,7,9,12,17,20,22,24,26-dodecaene;8-dibenzofuran-2-yl-4-(2,5-diphenyl-1,2,4-triazol-3-yl)-19-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5(10),6,8,12,17,20,22,24,26-dodecaene;14-(3,5-dimethylphenyl)-29-(2,4-diphenylpyrimidin-5-yl)-18-thia-14,29-diazaoctacyclo[15.14.0.03,15.04,13.07,12.019,31.022,30.023,28]hentriaconta-1(17),2,4(13),5,7,9,11,15,19(31),20,22(30),23,25,27-tetradecaene
PubChem CID157184092
Molecular FormulaC165H102N14OS3
Molecular Weight2392.93 g/mol
Exact Mass2390.75
IUPAC Name19-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-4-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5,7,9,12,17,20,22,24,26-dodecaene;8-dibenzofuran-2-yl-4-(2,5-diphenyl-1,2,4-triazol-3-yl)-19-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5(10),6,8,12,17,20,22,24,26-dodecaene;14-(3,5-dimethylphenyl)-29-(2,4-diphenylpyrimidin-5-yl)-18-thia-14,29-diazaoctacyclo[15.14.0.03,15.04,13.07,12.019,31.022,30.023,28]hentriaconta-1(17),2,4(13),5,7,9,11,15,19(31),20,22(30),23,25,27-tetradecaene
SMILESCc1cc(C)cc(-n2c3cc4sc5ccc6c7ccccc7n(-c7cnc(-c8ccccc8)nc7-c7ccccc7)c6c5c4cc3c3ccc4ccccc4c32)c1.c1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-n4c5ccccc5c5cc6c(cc54)sc4ccc5c7ccccc7n(-c7ccccc7)c5c46)n3)cc2)cc1.c1ccc(-c2nc(-n3c4ccc(-c5ccc6oc7ccccc7c6c5)cc4c4ccc5sc6cc7c(cc6c5c43)c3ccccc3n7-c3ccccc3)n(-c3ccccc3)n2)cc1
InChIInChI=1S/C57H35N5S.C56H33N5OS.C52H34N4S/c1-4-14-36(15-5-1)38-24-28-40(29-25-38)55-58-56(41-30-26-39(27-31-41)37-16-6-2-7-17-37)60-57(59-55)62-49-23-13-11-21-44(49)46-34-47-52(35-50(46)62)63-51-33-32-45-43-20-10-12-22-48(43)61(54(45)53(47)51)42-18-8-3-9-19-42;1-4-14-34(15-5-1)55-57-56(61(58-55)38-18-8-3-9-19-38)60-47-27-24-35(36-25-28-50-44(31-36)40-21-11-13-23-49(40)62-50)30-42(47)41-26-29-51-53(54(41)60)45-32-43-39-20-10-12-22-46(39)59(37-16-6-2-7-17-37)48(43)33-52(45)63-51;1-31-25-32(2)27-36(26-31)55-44-29-47-42(28-41(44)40-22-21-33-13-9-10-18-37(33)50(40)55)48-46(57-47)24-23-39-38-19-11-12-20-43(38)56(51(39)48)45-30-53-52(35-16-7-4-8-17-35)54-49(45)34-14-5-3-6-15-34/h1-35H;1-33H;3-30H,1-2H3
InChIKeyAOXHGYIPKUKNPB-UHFFFAOYSA-N
XLogP44.31
TPSA137.88 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds15
Heavy Atoms183
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002392.93
LogP ≤ 544.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Analyze 19-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-4-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5,7,9,12,17,20,22,24,26-dodecaene;8-dibenzofuran-2-yl-4-(2,5-diphenyl-1,2,4-triazol-3-yl)-19-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5(10),6,8,12,17,20,22,24,26-dodecaene;14-(3,5-dimethylphenyl)-29-(2,4-diphenylpyrimidin-5-yl)-18-thia-14,29-diazaoctacyclo[15.14.0.03,15.04,13.07,12.019,31.022,30.023,28]hentriaconta-1(17),2,4(13),5,7,9,11,15,19(31),20,22(30),23,25,27-tetradecaene with MolForge

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Related Compounds

18-(4-Dibenzofuran-2-yl-[1]benzothiolo[3,2-d]pyrimidin-2-yl)-22-fluoro-5-isoquinolin-5-yl-9-thia-18-azahexacyclo[15.7.0.02,10.03,8.011,16.019,24]tetracosa-1(17),2(10),3(8),4,6,11,13,15,19(24),20,22-undecaene
CID 134276447
CID 157388239
CID 157388239
6-fluoro-7-methoxy-1-(4-methylphenyl)-3-(trifluoromethyl)-5H-isothiochromeno[4,3-c]pyrazole;1-[3-(4-fluorophenyl)-2-(4-methylphenyl)imidazo[1,2-a]pyridin-8-yl]ethanone;7-methoxy-1-(4-methylphenyl)-3-(trifluoromethyl)benzo[g]indazole;2-(4-methylphenyl)-3-phenyl-1-benzofuran;5-(4-methylphenyl)-6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazole
CID 158789828
CID 159393370
CID 159393370
3,6-dimethyl-9H-carbazole;2,8-dimethyldibenzofuran;4,5-dimethyl-1,2-diphenylimidazole;2,3-dimethyl-1,5-diphenylpyrrole;3,5-dimethyl-1-phenylpyrazole;2,3-dimethyl-5-phenylthiophene;3,5-dimethyl-4-phenyl-1,2,4-triazole;2,5-dimethylthiophene;3,5-dimethyl-1-(trifluoromethyl)pyrazole;3,5-dimethyl-4-(trifluoromethyl)-1,2,4-triazole
CID 160933825
12-Dibenzothiophen-4-yl-23-thia-10-azahexacyclo[12.11.0.02,11.03,8.016,24.017,22]pentacosa-1(25),2(11),3,5,7,9,12,14,16(24),17,19,21-dodecaene;20-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-18-methyl-10-oxa-15-azapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene;17-methyl-20-(9-phenylcarbazol-3-yl)-10-thia-15,18-diazapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene;15-methyl-20-[9-[4-(trifluoromethyl)phenyl]carbazol-3-yl]-10-thia-18-azapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene
CID 161901264
4-[3-[8-[3-[4,6-Bis(4-phenylpyrimidin-2-yl)-8-(2-pyridin-2-yl-3-pyridinyl)dibenzofuran-2-yl]phenyl]-4b,9b-dihydro-[1]benzothiolo[3,2-b][1]benzothiol-3-yl]phenyl]-8-[2-methyl-3-(2-methyl-3-pyrazin-2-ylphenyl)phenyl]-12-(2-pyrazin-2-yl-3-pyridinyl)-5,8,11-triazatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaene
CID 57958245
3-[3-[3-[8-Dibenzothiophen-2-yl-1-[8-dibenzothiophen-2-yl-4-[3-[3-(9-pyrimidin-5-ylcarbazol-3-yl)phenyl]phenyl]dibenzofuran-1-yl]dibenzofuran-4-yl]phenyl]phenyl]-9-pyrimidin-5-ylcarbazole
CID 58059158
CID 59358459
CID 59358459
CID 59358566
CID 59358566
CID 59358842
CID 59358842
CID 59359312
CID 59359312

Frequently Asked Questions

What is the IUPAC name of 19-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-4-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5,7,9,12,17,20,22,24,26-dodecaene;8-dibenzofuran-2-yl-4-(2,5-diphenyl-1,2,4-triazol-3-yl)-19-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5(10),6,8,12,17,20,22,24,26-dodecaene;14-(3,5-dimethylphenyl)-29-(2,4-diphenylpyrimidin-5-yl)-18-thia-14,29-diazaoctacyclo[15.14.0.03,15.04,13.07,12.019,31.022,30.023,28]hentriaconta-1(17),2,4(13),5,7,9,11,15,19(31),20,22(30),23,25,27-tetradecaene?
The IUPAC name of 19-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-4-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5,7,9,12,17,20,22,24,26-dodecaene;8-dibenzofuran-2-yl-4-(2,5-diphenyl-1,2,4-triazol-3-yl)-19-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5(10),6,8,12,17,20,22,24,26-dodecaene;14-(3,5-dimethylphenyl)-29-(2,4-diphenylpyrimidin-5-yl)-18-thia-14,29-diazaoctacyclo[15.14.0.03,15.04,13.07,12.019,31.022,30.023,28]hentriaconta-1(17),2,4(13),5,7,9,11,15,19(31),20,22(30),23,25,27-tetradecaene (CID 157184092) is 19-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-4-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5,7,9,12,17,20,22,24,26-dodecaene;8-dibenzofuran-2-yl-4-(2,5-diphenyl-1,2,4-triazol-3-yl)-19-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5(10),6,8,12,17,20,22,24,26-dodecaene;14-(3,5-dimethylphenyl)-29-(2,4-diphenylpyrimidin-5-yl)-18-thia-14,29-diazaoctacyclo[15.14.0.03,15.04,13.07,12.019,31.022,30.023,28]hentriaconta-1(17),2,4(13),5,7,9,11,15,19(31),20,22(30),23,25,27-tetradecaene.
What is the SMILES notation for 19-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-4-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5,7,9,12,17,20,22,24,26-dodecaene;8-dibenzofuran-2-yl-4-(2,5-diphenyl-1,2,4-triazol-3-yl)-19-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5(10),6,8,12,17,20,22,24,26-dodecaene;14-(3,5-dimethylphenyl)-29-(2,4-diphenylpyrimidin-5-yl)-18-thia-14,29-diazaoctacyclo[15.14.0.03,15.04,13.07,12.019,31.022,30.023,28]hentriaconta-1(17),2,4(13),5,7,9,11,15,19(31),20,22(30),23,25,27-tetradecaene?
The canonical SMILES for 19-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-4-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5,7,9,12,17,20,22,24,26-dodecaene;8-dibenzofuran-2-yl-4-(2,5-diphenyl-1,2,4-triazol-3-yl)-19-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5(10),6,8,12,17,20,22,24,26-dodecaene;14-(3,5-dimethylphenyl)-29-(2,4-diphenylpyrimidin-5-yl)-18-thia-14,29-diazaoctacyclo[15.14.0.03,15.04,13.07,12.019,31.022,30.023,28]hentriaconta-1(17),2,4(13),5,7,9,11,15,19(31),20,22(30),23,25,27-tetradecaene is Cc1cc(C)cc(-n2c3cc4sc5ccc6c7ccccc7n(-c7cnc(-c8ccccc8)nc7-c7ccccc7)c6c5c4cc3c3ccc4ccccc4c32)c1.c1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-n4c5ccccc5c5cc6c(cc54)sc4ccc5c7ccccc7n(-c7ccccc7)c5c46)n3)cc2)cc1.c1ccc(-c2nc(-n3c4ccc(-c5ccc6oc7ccccc7c6c5)cc4c4ccc5sc6cc7c(cc6c5c43)c3ccccc3n7-c3ccccc3)n(-c3ccccc3)n2)cc1.
What is the InChIKey of 19-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-4-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5,7,9,12,17,20,22,24,26-dodecaene;8-dibenzofuran-2-yl-4-(2,5-diphenyl-1,2,4-triazol-3-yl)-19-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5(10),6,8,12,17,20,22,24,26-dodecaene;14-(3,5-dimethylphenyl)-29-(2,4-diphenylpyrimidin-5-yl)-18-thia-14,29-diazaoctacyclo[15.14.0.03,15.04,13.07,12.019,31.022,30.023,28]hentriaconta-1(17),2,4(13),5,7,9,11,15,19(31),20,22(30),23,25,27-tetradecaene?
The InChIKey is AOXHGYIPKUKNPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C57H35N5S.C56H33N5OS.C52H34N4S/c1-4-14-36(15-5-1)38-24-28-40(29-25-38)55-58-56(41-30-26-39(27-31-41)37-16-6-2-7-17-37)60-57(59-55)62-49-23-13-11-21-44(49)46-34-47-52(35-50(46)62)63-51-33-32-45-43-20-10-12-22-48(43)61(54(45)53(47)51)42-18-8-3-9-19-42;1-4-14-34(15-5-1)55-57-56(61(58-55)38-18-8-3-9-19-38)60-47-27-24-35(36-25-28-50-44(31-36)40-21-11-13-23-49(40)62-50)30-42(47)41-26-29-51-53(54(41)60)45-32-43-39-20-10-12-22-46(39)59(37-16-6-2-7-17-37)48(43)33-52(45)63-51;1-31-25-32(2)27-36(26-31)55-44-29-47-42(28-41(44)40-22-21-33-13-9-10-18-37(33)50(40)55)48-46(57-47)24-23-39-38-19-11-12-20-43(38)56(51(39)48)45-30-53-52(35-16-7-4-8-17-35)54-49(45)34-14-5-3-6-15-34/h1-35H;1-33H;3-30H,1-2H3.
What are the key properties of 19-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-4-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5,7,9,12,17,20,22,24,26-dodecaene;8-dibenzofuran-2-yl-4-(2,5-diphenyl-1,2,4-triazol-3-yl)-19-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5(10),6,8,12,17,20,22,24,26-dodecaene;14-(3,5-dimethylphenyl)-29-(2,4-diphenylpyrimidin-5-yl)-18-thia-14,29-diazaoctacyclo[15.14.0.03,15.04,13.07,12.019,31.022,30.023,28]hentriaconta-1(17),2,4(13),5,7,9,11,15,19(31),20,22(30),23,25,27-tetradecaene?
19-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-4-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5,7,9,12,17,20,22,24,26-dodecaene;8-dibenzofuran-2-yl-4-(2,5-diphenyl-1,2,4-triazol-3-yl)-19-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5(10),6,8,12,17,20,22,24,26-dodecaene;14-(3,5-dimethylphenyl)-29-(2,4-diphenylpyrimidin-5-yl)-18-thia-14,29-diazaoctacyclo[15.14.0.03,15.04,13.07,12.019,31.022,30.023,28]hentriaconta-1(17),2,4(13),5,7,9,11,15,19(31),20,22(30),23,25,27-tetradecaene has a molecular weight of 2392.93 g/mol, XLogP of 44.31, 15 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 19-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-4-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5,7,9,12,17,20,22,24,26-dodecaene;8-dibenzofuran-2-yl-4-(2,5-diphenyl-1,2,4-triazol-3-yl)-19-phenyl-15-thia-4,19-diazaheptacyclo[14.11.0.02,14.03,11.05,10.018,26.020,25]heptacosa-1(16),2(14),3(11),5(10),6,8,12,17,20,22,24,26-dodecaene;14-(3,5-dimethylphenyl)-29-(2,4-diphenylpyrimidin-5-yl)-18-thia-14,29-diazaoctacyclo[15.14.0.03,15.04,13.07,12.019,31.022,30.023,28]hentriaconta-1(17),2,4(13),5,7,9,11,15,19(31),20,22(30),23,25,27-tetradecaene is sourced from PubChem (CID 157184092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).