3-anthracen-9-yl-7-[9-(20-naphthalen-2-yl-20-azahexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaen-6-yl)carbazol-3-yl]-10-phenylphenothiazine;3-dibenzothiophen-2-yl-9-(9,9-dimethyl-5-naphthalen-1-yl-9-silahexacyclo[13.6.2.02,10.03,8.012,22.019,23]tricosa-1(22),2(10),3(8),4,6,11,13,15(23),16,18,20-undecaen-20-yl)carbazole;3-[9-(20,20-diphenyl-6-hexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaenyl)carbazol-3-yl]-10-(4-naphthalen-1-ylphenyl)-7-phenylphenoxazine;10-(4-naphthalen-1-ylphenyl)-3-[9-(3-pyridin-2-yl-3-azahexacyclo[13.6.2.02,10.04,9.012,22.019,23]tricosa-1(22),2(10),4,6,8,11,13,15,17,19(23),20-undecaen-14-yl)carbazol-3-yl]phenoxazine

C282H172N10O2S2Si — CID 157447140

IUPAC3-anthracen-9-yl-7-[9-(20-naphthalen-2-yl-20-azahexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaen-6-yl)carbazol-3-yl]-10-phenylphenothiazine;3-dibenzothiophen-2-yl-9-(9,9-dimethyl-5-naphthalen-1-yl-9-silahexacyclo[13.6.2.02,10.03,8.012,22.019,23]tricosa-1(22),2(10),3(8),4,6,11,13,15(23),16,18,20-undecaen-20-yl)carbazole;3-[9-(20,20-diphenyl-6-hexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaenyl)carbazol-3-yl]-10-(4-naphthalen-1-ylphenyl)-7-phenylphenoxazine;10-(4-naphthalen-1-ylphenyl)-3-[9-(3-pyridin-2-yl-3-azahexacyclo[13.6.2.02,10.04,9.012,22.019,23]tricosa-1(22),2(10),4,6,8,11,13,15,17,19(23),20-undecaen-14-yl)carbazol-3-yl]phenoxazine
SMILESC[Si]1(C)c2ccc(-c3cccc4ccccc34)cc2-c2c1cc1ccc3cccc4c(-n5c6ccccc6c6cc(-c7ccc8sc9ccccc9c8c7)ccc65)cc2c1c34.c1ccc(-c2ccc3c(c2)Oc2cc(-c4ccc5c(c4)c4ccccc4n5-c4cc5cccc6c7c(c8cccc4c8c56)C(c4ccccc4)(c4ccccc4)c4ccccc4-7)ccc2N3c2ccc(-c3cccc4ccccc34)cc2)cc1.c1ccc(-n2c3ccccc3c3cc4cc(-n5c6ccccc6c6cc(-c7ccc8c(c7)Oc7ccccc7N8c7ccc(-c8cccc9ccccc89)cc7)ccc65)c5cccc6ccc(c4c65)c32)nc1.c1ccc(N2c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4cc5cccc6c5c5c4cccc5c4c6c5ccccc5n4-c4ccc5ccccc5c4)cc3Sc3cc(-c4c5ccccc5cc5ccccc45)ccc32)cc1
InChIInChI=1S/C81H50N2O.C76H45N3S.C67H40N4O.C58H37NSSi/c1-4-19-51(20-5-1)55-40-45-72-75(49-55)84-76-50-56(41-46-73(76)82(72)60-42-37-53(38-43-60)62-31-16-22-52-21-10-11-28-61(52)62)54-39-44-71-68(47-54)63-29-13-15-36-70(63)83(71)74-48-57-23-17-33-66-77(57)78-65(74)32-18-34-67(78)80-79(66)64-30-12-14-35-69(64)81(80,58-24-6-2-7-25-58)59-26-8-3-9-27-59;1-2-21-54(22-3-1)77-67-38-34-49(44-70(67)80-71-45-53(35-39-68(71)77)72-56-23-8-6-18-50(56)40-51-19-7-9-24-57(51)72)48-33-37-66-63(42-48)58-25-10-12-30-64(58)79(66)69-43-52-20-14-28-61-73(52)74-60(69)27-15-29-62(74)76-75(61)59-26-11-13-31-65(59)78(76)55-36-32-46-16-4-5-17-47(46)41-55;1-2-16-48-41(13-1)14-11-19-49(48)42-26-31-47(32-27-42)69-59-23-7-8-24-62(59)72-63-40-45(30-35-60(63)69)44-29-34-58-54(37-44)50-17-3-5-21-56(50)70(58)61-39-46-38-55-51-18-4-6-22-57(51)71(64-25-9-10-36-68-64)67(55)53-33-28-43-15-12-20-52(61)65(43)66(46)53;1-61(2)54-28-25-38(41-17-9-12-34-11-3-4-14-40(34)41)31-47(54)58-48-33-51(44-18-10-13-35-21-22-39(32-55(58)61)57(48)56(35)44)59-49-19-7-5-15-42(49)45-29-36(23-26-50(45)59)37-24-27-53-46(30-37)43-16-6-8-20-52(43)60-53/h1-50H;1-45H;1-40H;3-33H,1-2H3
InChIKeyBSIVRRSFIQHAEM-UHFFFAOYSA-N
MW3824.77 g/mol
LogP76.86
Rot. Bonds20

About 3-anthracen-9-yl-7-[9-(20-naphthalen-2-yl-20-azahexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaen-6-yl)carbazol-3-yl]-10-phenylphenothiazine;3-dibenzothiophen-2-yl-9-(9,9-dimethyl-5-naphthalen-1-yl-9-silahexacyclo[13.6.2.02,10.03,8.012,22.019,23]tricosa-1(22),2(10),3(8),4,6,11,13,15(23),16,18,20-undecaen-20-yl)carbazole;3-[9-(20,20-diphenyl-6-hexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaenyl)carbazol-3-yl]-10-(4-naphthalen-1-ylphenyl)-7-phenylphenoxazine;10-(4-naphthalen-1-ylphenyl)-3-[9-(3-pyridin-2-yl-3-azahexacyclo[13.6.2.02,10.04,9.012,22.019,23]tricosa-1(22),2(10),4,6,8,11,13,15,17,19(23),20-undecaen-14-yl)carbazol-3-yl]phenoxazine

3-anthracen-9-yl-7-[9-(20-naphthalen-2-yl-20-azahexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaen-6-yl)carbazol-3-yl]-10-phenylphenothiazine;3-dibenzothiophen-2-yl-9-(9,9-dimethyl-5-naphthalen-1-yl-9-silahexacyclo[13.6.2.02,10.03,8.012,22.019,23]tricosa-1(22),2(10),3(8),4,6,11,13,15(23),16,18,20-undecaen-20-yl)carbazole;3-[9-(20,20-diphenyl-6-hexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaenyl)carbazol-3-yl]-10-(4-naphthalen-1-ylphenyl)-7-phenylphenoxazine;10-(4-naphthalen-1-ylphenyl)-3-[9-(3-pyridin-2-yl-3-azahexacyclo[13.6.2.02,10.04,9.012,22.019,23]tricosa-1(22),2(10),4,6,8,11,13,15,17,19(23),20-undecaen-14-yl)carbazol-3-yl]phenoxazine (PubChem CID 157447140) has the molecular formula C282H172N10O2S2Si and a molecular weight of 3824.77 g/mol. Its IUPAC name is 3-anthracen-9-yl-7-[9-(20-naphthalen-2-yl-20-azahexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaen-6-yl)carbazol-3-yl]-10-phenylphenothiazine;3-dibenzothiophen-2-yl-9-(9,9-dimethyl-5-naphthalen-1-yl-9-silahexacyclo[13.6.2.02,10.03,8.012,22.019,23]tricosa-1(22),2(10),3(8),4,6,11,13,15(23),16,18,20-undecaen-20-yl)carbazole;3-[9-(20,20-diphenyl-6-hexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaenyl)carbazol-3-yl]-10-(4-naphthalen-1-ylphenyl)-7-phenylphenoxazine;10-(4-naphthalen-1-ylphenyl)-3-[9-(3-pyridin-2-yl-3-azahexacyclo[13.6.2.02,10.04,9.012,22.019,23]tricosa-1(22),2(10),4,6,8,11,13,15,17,19(23),20-undecaen-14-yl)carbazol-3-yl]phenoxazine.

Molecular Properties

Compound Name3-anthracen-9-yl-7-[9-(20-naphthalen-2-yl-20-azahexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaen-6-yl)carbazol-3-yl]-10-phenylphenothiazine;3-dibenzothiophen-2-yl-9-(9,9-dimethyl-5-naphthalen-1-yl-9-silahexacyclo[13.6.2.02,10.03,8.012,22.019,23]tricosa-1(22),2(10),3(8),4,6,11,13,15(23),16,18,20-undecaen-20-yl)carbazole;3-[9-(20,20-diphenyl-6-hexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaenyl)carbazol-3-yl]-10-(4-naphthalen-1-ylphenyl)-7-phenylphenoxazine;10-(4-naphthalen-1-ylphenyl)-3-[9-(3-pyridin-2-yl-3-azahexacyclo[13.6.2.02,10.04,9.012,22.019,23]tricosa-1(22),2(10),4,6,8,11,13,15,17,19(23),20-undecaen-14-yl)carbazol-3-yl]phenoxazine
PubChem CID157447140
Molecular FormulaC282H172N10O2S2Si
Molecular Weight3824.77 g/mol
Exact Mass3821.29
IUPAC Name3-anthracen-9-yl-7-[9-(20-naphthalen-2-yl-20-azahexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaen-6-yl)carbazol-3-yl]-10-phenylphenothiazine;3-dibenzothiophen-2-yl-9-(9,9-dimethyl-5-naphthalen-1-yl-9-silahexacyclo[13.6.2.02,10.03,8.012,22.019,23]tricosa-1(22),2(10),3(8),4,6,11,13,15(23),16,18,20-undecaen-20-yl)carbazole;3-[9-(20,20-diphenyl-6-hexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaenyl)carbazol-3-yl]-10-(4-naphthalen-1-ylphenyl)-7-phenylphenoxazine;10-(4-naphthalen-1-ylphenyl)-3-[9-(3-pyridin-2-yl-3-azahexacyclo[13.6.2.02,10.04,9.012,22.019,23]tricosa-1(22),2(10),4,6,8,11,13,15,17,19(23),20-undecaen-14-yl)carbazol-3-yl]phenoxazine
SMILESC[Si]1(C)c2ccc(-c3cccc4ccccc34)cc2-c2c1cc1ccc3cccc4c(-n5c6ccccc6c6cc(-c7ccc8sc9ccccc9c8c7)ccc65)cc2c1c34.c1ccc(-c2ccc3c(c2)Oc2cc(-c4ccc5c(c4)c4ccccc4n5-c4cc5cccc6c7c(c8cccc4c8c56)C(c4ccccc4)(c4ccccc4)c4ccccc4-7)ccc2N3c2ccc(-c3cccc4ccccc34)cc2)cc1.c1ccc(-n2c3ccccc3c3cc4cc(-n5c6ccccc6c6cc(-c7ccc8c(c7)Oc7ccccc7N8c7ccc(-c8cccc9ccccc89)cc7)ccc65)c5cccc6ccc(c4c65)c32)nc1.c1ccc(N2c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4cc5cccc6c5c5c4cccc5c4c6c5ccccc5n4-c4ccc5ccccc5c4)cc3Sc3cc(-c4c5ccccc5cc5ccccc45)ccc32)cc1
InChIInChI=1S/C81H50N2O.C76H45N3S.C67H40N4O.C58H37NSSi/c1-4-19-51(20-5-1)55-40-45-72-75(49-55)84-76-50-56(41-46-73(76)82(72)60-42-37-53(38-43-60)62-31-16-22-52-21-10-11-28-61(52)62)54-39-44-71-68(47-54)63-29-13-15-36-70(63)83(71)74-48-57-23-17-33-66-77(57)78-65(74)32-18-34-67(78)80-79(66)64-30-12-14-35-69(64)81(80,58-24-6-2-7-25-58)59-26-8-3-9-27-59;1-2-21-54(22-3-1)77-67-38-34-49(44-70(67)80-71-45-53(35-39-68(71)77)72-56-23-8-6-18-50(56)40-51-19-7-9-24-57(51)72)48-33-37-66-63(42-48)58-25-10-12-30-64(58)79(66)69-43-52-20-14-28-61-73(52)74-60(69)27-15-29-62(74)76-75(61)59-26-11-13-31-65(59)78(76)55-36-32-46-16-4-5-17-47(46)41-55;1-2-16-48-41(13-1)14-11-19-49(48)42-26-31-47(32-27-42)69-59-23-7-8-24-62(59)72-63-40-45(30-35-60(63)69)44-29-34-58-54(37-44)50-17-3-5-21-56(50)70(58)61-39-46-38-55-51-18-4-6-22-57(51)71(64-25-9-10-36-68-64)67(55)53-33-28-43-15-12-20-52(61)65(43)66(46)53;1-61(2)54-28-25-38(41-17-9-12-34-11-3-4-14-40(34)41)31-47(54)58-48-33-51(44-18-10-13-35-21-22-39(32-55(58)61)57(48)56(35)44)59-49-19-7-5-15-42(49)45-29-36(23-26-50(45)59)37-24-27-53-46(30-37)43-16-6-8-20-52(43)60-53/h1-50H;1-45H;1-40H;3-33H,1-2H3
InChIKeyBSIVRRSFIQHAEM-UHFFFAOYSA-N
XLogP76.86
TPSA70.65 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds20
Heavy Atoms297
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003824.77
LogP ≤ 576.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 3-anthracen-9-yl-7-[9-(20-naphthalen-2-yl-20-azahexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaen-6-yl)carbazol-3-yl]-10-phenylphenothiazine;3-dibenzothiophen-2-yl-9-(9,9-dimethyl-5-naphthalen-1-yl-9-silahexacyclo[13.6.2.02,10.03,8.012,22.019,23]tricosa-1(22),2(10),3(8),4,6,11,13,15(23),16,18,20-undecaen-20-yl)carbazole;3-[9-(20,20-diphenyl-6-hexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaenyl)carbazol-3-yl]-10-(4-naphthalen-1-ylphenyl)-7-phenylphenoxazine;10-(4-naphthalen-1-ylphenyl)-3-[9-(3-pyridin-2-yl-3-azahexacyclo[13.6.2.02,10.04,9.012,22.019,23]tricosa-1(22),2(10),4,6,8,11,13,15,17,19(23),20-undecaen-14-yl)carbazol-3-yl]phenoxazine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-anthracen-9-yl-7-[9-(20-naphthalen-2-yl-20-azahexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaen-6-yl)carbazol-3-yl]-10-phenylphenothiazine;3-dibenzothiophen-2-yl-9-(9,9-dimethyl-5-naphthalen-1-yl-9-silahexacyclo[13.6.2.02,10.03,8.012,22.019,23]tricosa-1(22),2(10),3(8),4,6,11,13,15(23),16,18,20-undecaen-20-yl)carbazole;3-[9-(20,20-diphenyl-6-hexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaenyl)carbazol-3-yl]-10-(4-naphthalen-1-ylphenyl)-7-phenylphenoxazine;10-(4-naphthalen-1-ylphenyl)-3-[9-(3-pyridin-2-yl-3-azahexacyclo[13.6.2.02,10.04,9.012,22.019,23]tricosa-1(22),2(10),4,6,8,11,13,15,17,19(23),20-undecaen-14-yl)carbazol-3-yl]phenoxazine?
The IUPAC name of 3-anthracen-9-yl-7-[9-(20-naphthalen-2-yl-20-azahexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaen-6-yl)carbazol-3-yl]-10-phenylphenothiazine;3-dibenzothiophen-2-yl-9-(9,9-dimethyl-5-naphthalen-1-yl-9-silahexacyclo[13.6.2.02,10.03,8.012,22.019,23]tricosa-1(22),2(10),3(8),4,6,11,13,15(23),16,18,20-undecaen-20-yl)carbazole;3-[9-(20,20-diphenyl-6-hexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaenyl)carbazol-3-yl]-10-(4-naphthalen-1-ylphenyl)-7-phenylphenoxazine;10-(4-naphthalen-1-ylphenyl)-3-[9-(3-pyridin-2-yl-3-azahexacyclo[13.6.2.02,10.04,9.012,22.019,23]tricosa-1(22),2(10),4,6,8,11,13,15,17,19(23),20-undecaen-14-yl)carbazol-3-yl]phenoxazine (CID 157447140) is 3-anthracen-9-yl-7-[9-(20-naphthalen-2-yl-20-azahexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaen-6-yl)carbazol-3-yl]-10-phenylphenothiazine;3-dibenzothiophen-2-yl-9-(9,9-dimethyl-5-naphthalen-1-yl-9-silahexacyclo[13.6.2.02,10.03,8.012,22.019,23]tricosa-1(22),2(10),3(8),4,6,11,13,15(23),16,18,20-undecaen-20-yl)carbazole;3-[9-(20,20-diphenyl-6-hexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaenyl)carbazol-3-yl]-10-(4-naphthalen-1-ylphenyl)-7-phenylphenoxazine;10-(4-naphthalen-1-ylphenyl)-3-[9-(3-pyridin-2-yl-3-azahexacyclo[13.6.2.02,10.04,9.012,22.019,23]tricosa-1(22),2(10),4,6,8,11,13,15,17,19(23),20-undecaen-14-yl)carbazol-3-yl]phenoxazine.
What is the SMILES notation for 3-anthracen-9-yl-7-[9-(20-naphthalen-2-yl-20-azahexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaen-6-yl)carbazol-3-yl]-10-phenylphenothiazine;3-dibenzothiophen-2-yl-9-(9,9-dimethyl-5-naphthalen-1-yl-9-silahexacyclo[13.6.2.02,10.03,8.012,22.019,23]tricosa-1(22),2(10),3(8),4,6,11,13,15(23),16,18,20-undecaen-20-yl)carbazole;3-[9-(20,20-diphenyl-6-hexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaenyl)carbazol-3-yl]-10-(4-naphthalen-1-ylphenyl)-7-phenylphenoxazine;10-(4-naphthalen-1-ylphenyl)-3-[9-(3-pyridin-2-yl-3-azahexacyclo[13.6.2.02,10.04,9.012,22.019,23]tricosa-1(22),2(10),4,6,8,11,13,15,17,19(23),20-undecaen-14-yl)carbazol-3-yl]phenoxazine?
The canonical SMILES for 3-anthracen-9-yl-7-[9-(20-naphthalen-2-yl-20-azahexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaen-6-yl)carbazol-3-yl]-10-phenylphenothiazine;3-dibenzothiophen-2-yl-9-(9,9-dimethyl-5-naphthalen-1-yl-9-silahexacyclo[13.6.2.02,10.03,8.012,22.019,23]tricosa-1(22),2(10),3(8),4,6,11,13,15(23),16,18,20-undecaen-20-yl)carbazole;3-[9-(20,20-diphenyl-6-hexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaenyl)carbazol-3-yl]-10-(4-naphthalen-1-ylphenyl)-7-phenylphenoxazine;10-(4-naphthalen-1-ylphenyl)-3-[9-(3-pyridin-2-yl-3-azahexacyclo[13.6.2.02,10.04,9.012,22.019,23]tricosa-1(22),2(10),4,6,8,11,13,15,17,19(23),20-undecaen-14-yl)carbazol-3-yl]phenoxazine is C[Si]1(C)c2ccc(-c3cccc4ccccc34)cc2-c2c1cc1ccc3cccc4c(-n5c6ccccc6c6cc(-c7ccc8sc9ccccc9c8c7)ccc65)cc2c1c34.c1ccc(-c2ccc3c(c2)Oc2cc(-c4ccc5c(c4)c4ccccc4n5-c4cc5cccc6c7c(c8cccc4c8c56)C(c4ccccc4)(c4ccccc4)c4ccccc4-7)ccc2N3c2ccc(-c3cccc4ccccc34)cc2)cc1.c1ccc(-n2c3ccccc3c3cc4cc(-n5c6ccccc6c6cc(-c7ccc8c(c7)Oc7ccccc7N8c7ccc(-c8cccc9ccccc89)cc7)ccc65)c5cccc6ccc(c4c65)c32)nc1.c1ccc(N2c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4cc5cccc6c5c5c4cccc5c4c6c5ccccc5n4-c4ccc5ccccc5c4)cc3Sc3cc(-c4c5ccccc5cc5ccccc45)ccc32)cc1.
What is the InChIKey of 3-anthracen-9-yl-7-[9-(20-naphthalen-2-yl-20-azahexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaen-6-yl)carbazol-3-yl]-10-phenylphenothiazine;3-dibenzothiophen-2-yl-9-(9,9-dimethyl-5-naphthalen-1-yl-9-silahexacyclo[13.6.2.02,10.03,8.012,22.019,23]tricosa-1(22),2(10),3(8),4,6,11,13,15(23),16,18,20-undecaen-20-yl)carbazole;3-[9-(20,20-diphenyl-6-hexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaenyl)carbazol-3-yl]-10-(4-naphthalen-1-ylphenyl)-7-phenylphenoxazine;10-(4-naphthalen-1-ylphenyl)-3-[9-(3-pyridin-2-yl-3-azahexacyclo[13.6.2.02,10.04,9.012,22.019,23]tricosa-1(22),2(10),4,6,8,11,13,15,17,19(23),20-undecaen-14-yl)carbazol-3-yl]phenoxazine?
The InChIKey is BSIVRRSFIQHAEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C81H50N2O.C76H45N3S.C67H40N4O.C58H37NSSi/c1-4-19-51(20-5-1)55-40-45-72-75(49-55)84-76-50-56(41-46-73(76)82(72)60-42-37-53(38-43-60)62-31-16-22-52-21-10-11-28-61(52)62)54-39-44-71-68(47-54)63-29-13-15-36-70(63)83(71)74-48-57-23-17-33-66-77(57)78-65(74)32-18-34-67(78)80-79(66)64-30-12-14-35-69(64)81(80,58-24-6-2-7-25-58)59-26-8-3-9-27-59;1-2-21-54(22-3-1)77-67-38-34-49(44-70(67)80-71-45-53(35-39-68(71)77)72-56-23-8-6-18-50(56)40-51-19-7-9-24-57(51)72)48-33-37-66-63(42-48)58-25-10-12-30-64(58)79(66)69-43-52-20-14-28-61-73(52)74-60(69)27-15-29-62(74)76-75(61)59-26-11-13-31-65(59)78(76)55-36-32-46-16-4-5-17-47(46)41-55;1-2-16-48-41(13-1)14-11-19-49(48)42-26-31-47(32-27-42)69-59-23-7-8-24-62(59)72-63-40-45(30-35-60(63)69)44-29-34-58-54(37-44)50-17-3-5-21-56(50)70(58)61-39-46-38-55-51-18-4-6-22-57(51)71(64-25-9-10-36-68-64)67(55)53-33-28-43-15-12-20-52(61)65(43)66(46)53;1-61(2)54-28-25-38(41-17-9-12-34-11-3-4-14-40(34)41)31-47(54)58-48-33-51(44-18-10-13-35-21-22-39(32-55(58)61)57(48)56(35)44)59-49-19-7-5-15-42(49)45-29-36(23-26-50(45)59)37-24-27-53-46(30-37)43-16-6-8-20-52(43)60-53/h1-50H;1-45H;1-40H;3-33H,1-2H3.
What are the key properties of 3-anthracen-9-yl-7-[9-(20-naphthalen-2-yl-20-azahexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaen-6-yl)carbazol-3-yl]-10-phenylphenothiazine;3-dibenzothiophen-2-yl-9-(9,9-dimethyl-5-naphthalen-1-yl-9-silahexacyclo[13.6.2.02,10.03,8.012,22.019,23]tricosa-1(22),2(10),3(8),4,6,11,13,15(23),16,18,20-undecaen-20-yl)carbazole;3-[9-(20,20-diphenyl-6-hexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaenyl)carbazol-3-yl]-10-(4-naphthalen-1-ylphenyl)-7-phenylphenoxazine;10-(4-naphthalen-1-ylphenyl)-3-[9-(3-pyridin-2-yl-3-azahexacyclo[13.6.2.02,10.04,9.012,22.019,23]tricosa-1(22),2(10),4,6,8,11,13,15,17,19(23),20-undecaen-14-yl)carbazol-3-yl]phenoxazine?
3-anthracen-9-yl-7-[9-(20-naphthalen-2-yl-20-azahexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaen-6-yl)carbazol-3-yl]-10-phenylphenothiazine;3-dibenzothiophen-2-yl-9-(9,9-dimethyl-5-naphthalen-1-yl-9-silahexacyclo[13.6.2.02,10.03,8.012,22.019,23]tricosa-1(22),2(10),3(8),4,6,11,13,15(23),16,18,20-undecaen-20-yl)carbazole;3-[9-(20,20-diphenyl-6-hexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaenyl)carbazol-3-yl]-10-(4-naphthalen-1-ylphenyl)-7-phenylphenoxazine;10-(4-naphthalen-1-ylphenyl)-3-[9-(3-pyridin-2-yl-3-azahexacyclo[13.6.2.02,10.04,9.012,22.019,23]tricosa-1(22),2(10),4,6,8,11,13,15,17,19(23),20-undecaen-14-yl)carbazol-3-yl]phenoxazine has a molecular weight of 3824.77 g/mol, XLogP of 76.86, 20 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 3-anthracen-9-yl-7-[9-(20-naphthalen-2-yl-20-azahexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaen-6-yl)carbazol-3-yl]-10-phenylphenothiazine;3-dibenzothiophen-2-yl-9-(9,9-dimethyl-5-naphthalen-1-yl-9-silahexacyclo[13.6.2.02,10.03,8.012,22.019,23]tricosa-1(22),2(10),3(8),4,6,11,13,15(23),16,18,20-undecaen-20-yl)carbazole;3-[9-(20,20-diphenyl-6-hexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5,7,9,11,13(21),14,16,18,22-undecaenyl)carbazol-3-yl]-10-(4-naphthalen-1-ylphenyl)-7-phenylphenoxazine;10-(4-naphthalen-1-ylphenyl)-3-[9-(3-pyridin-2-yl-3-azahexacyclo[13.6.2.02,10.04,9.012,22.019,23]tricosa-1(22),2(10),4,6,8,11,13,15,17,19(23),20-undecaen-14-yl)carbazol-3-yl]phenoxazine is sourced from PubChem (CID 157447140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).