2,6-bis[3-(9H-carbazol-4-yl)imidazo[4,5-b]pyridin-2-yl]-N,N-diphenylpyridin-4-amine;10-[2,6-bis(3-dibenzofuran-1-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]phenothiazine;10-[2,6-bis(1-phenylbenzimidazol-2-yl)-4-pyridinyl]-21,21-dimethyl-10,14-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;9-[2,6-bis(1-pyridin-4-ylbenzimidazol-2-yl)-4-pyridinyl]-3,6-dimethylcarbazole;10-[2,6-bis(3-pyridin-4-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]-9,9-dimethylacridine

C243H161N43O2S — CID 160794072

IUPAC2,6-bis[3-(9H-carbazol-4-yl)imidazo[4,5-b]pyridin-2-yl]-N,N-diphenylpyridin-4-amine;10-[2,6-bis(3-dibenzofuran-1-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]phenothiazine;10-[2,6-bis(1-phenylbenzimidazol-2-yl)-4-pyridinyl]-21,21-dimethyl-10,14-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;9-[2,6-bis(1-pyridin-4-ylbenzimidazol-2-yl)-4-pyridinyl]-3,6-dimethylcarbazole;10-[2,6-bis(3-pyridin-4-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]-9,9-dimethylacridine
SMILESCC1(C)c2ccccc2N(c2cc(-c3nc4cccnc4n3-c3ccncc3)nc(-c3nc4cccnc4n3-c3ccncc3)c2)c2ccccc21.CC1(C)c2ccccc2Nc2cc3c(cc21)c1ccccc1n3-c1cc(-c2nc3ccccc3n2-c2ccccc2)nc(-c2nc3ccccc3n2-c2ccccc2)c1.Cc1ccc2c(c1)c1cc(C)ccc1n2-c1cc(-c2nc3ccccc3n2-c2ccncc2)nc(-c2nc3ccccc3n2-c2ccncc2)c1.c1ccc(N(c2ccccc2)c2cc(-c3nc4cccnc4n3-c3cccc4[nH]c5ccccc5c34)nc(-c3nc4cccnc4n3-c3cccc4[nH]c5ccccc5c34)c2)cc1.c1ccc2c(c1)Sc1ccccc1N2c1cc(-c2nc3cccnc3n2-c2cccc3oc4ccccc4c23)nc(-c2nc3cccnc3n2-c2cccc3oc4ccccc4c23)c1
InChIInChI=1S/C53H34N10.C53H30N8O2S.C52H37N7.C43H30N8.C42H30N10/c1-3-15-33(16-4-1)61(34-17-5-2-6-18-34)35-31-44(52-59-42-25-13-29-54-50(42)62(52)46-27-11-23-40-48(46)36-19-7-9-21-38(36)56-40)58-45(32-35)53-60-43-26-14-30-55-51(43)63(53)47-28-12-24-41-49(47)37-20-8-10-22-39(37)57-41;1-5-21-42-32(13-1)48-40(19-9-23-44(48)62-42)60-50-34(15-11-27-54-50)57-52(60)36-29-31(59-38-17-3-7-25-46(38)64-47-26-8-4-18-39(47)59)30-37(56-36)53-58-35-16-12-28-55-51(35)61(53)41-20-10-24-45-49(41)33-14-2-6-22-43(33)63-45;1-52(2)38-22-10-11-23-40(38)53-43-32-49-37(31-39(43)52)36-21-9-14-26-46(36)57(49)35-29-44(50-55-41-24-12-15-27-47(41)58(50)33-17-5-3-6-18-33)54-45(30-35)51-56-42-25-13-16-28-48(42)59(51)34-19-7-4-8-20-34;1-27-11-13-38-32(23-27)33-24-28(2)12-14-39(33)49(38)31-25-36(42-47-34-7-3-5-9-40(34)50(42)29-15-19-44-20-16-29)46-37(26-31)43-48-35-8-4-6-10-41(35)51(43)30-17-21-45-22-18-30;1-42(2)30-9-3-5-13-36(30)50(37-14-6-4-10-31(37)42)29-25-34(40-48-32-11-7-19-45-38(32)51(40)27-15-21-43-22-16-27)47-35(26-29)41-49-33-12-8-20-46-39(33)52(41)28-17-23-44-24-18-28/h1-32,56-57H;1-30H;3-32,53H,1-2H3;3-26H,1-2H3;3-26H,1-2H3
InChIKeySCEYTCCUATYEMT-UHFFFAOYSA-N
MW3747.33 g/mol
LogP57.19
Rot. Bonds27

About 2,6-bis[3-(9H-carbazol-4-yl)imidazo[4,5-b]pyridin-2-yl]-N,N-diphenylpyridin-4-amine;10-[2,6-bis(3-dibenzofuran-1-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]phenothiazine;10-[2,6-bis(1-phenylbenzimidazol-2-yl)-4-pyridinyl]-21,21-dimethyl-10,14-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;9-[2,6-bis(1-pyridin-4-ylbenzimidazol-2-yl)-4-pyridinyl]-3,6-dimethylcarbazole;10-[2,6-bis(3-pyridin-4-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]-9,9-dimethylacridine

2,6-bis[3-(9H-carbazol-4-yl)imidazo[4,5-b]pyridin-2-yl]-N,N-diphenylpyridin-4-amine;10-[2,6-bis(3-dibenzofuran-1-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]phenothiazine;10-[2,6-bis(1-phenylbenzimidazol-2-yl)-4-pyridinyl]-21,21-dimethyl-10,14-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;9-[2,6-bis(1-pyridin-4-ylbenzimidazol-2-yl)-4-pyridinyl]-3,6-dimethylcarbazole;10-[2,6-bis(3-pyridin-4-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]-9,9-dimethylacridine (PubChem CID 160794072) has the molecular formula C243H161N43O2S and a molecular weight of 3747.33 g/mol. Its IUPAC name is 2,6-bis[3-(9H-carbazol-4-yl)imidazo[4,5-b]pyridin-2-yl]-N,N-diphenylpyridin-4-amine;10-[2,6-bis(3-dibenzofuran-1-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]phenothiazine;10-[2,6-bis(1-phenylbenzimidazol-2-yl)-4-pyridinyl]-21,21-dimethyl-10,14-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;9-[2,6-bis(1-pyridin-4-ylbenzimidazol-2-yl)-4-pyridinyl]-3,6-dimethylcarbazole;10-[2,6-bis(3-pyridin-4-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]-9,9-dimethylacridine.

Molecular Properties

Compound Name2,6-bis[3-(9H-carbazol-4-yl)imidazo[4,5-b]pyridin-2-yl]-N,N-diphenylpyridin-4-amine;10-[2,6-bis(3-dibenzofuran-1-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]phenothiazine;10-[2,6-bis(1-phenylbenzimidazol-2-yl)-4-pyridinyl]-21,21-dimethyl-10,14-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;9-[2,6-bis(1-pyridin-4-ylbenzimidazol-2-yl)-4-pyridinyl]-3,6-dimethylcarbazole;10-[2,6-bis(3-pyridin-4-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]-9,9-dimethylacridine
PubChem CID160794072
Molecular FormulaC243H161N43O2S
Molecular Weight3747.33 g/mol
Exact Mass3744.35
IUPAC Name2,6-bis[3-(9H-carbazol-4-yl)imidazo[4,5-b]pyridin-2-yl]-N,N-diphenylpyridin-4-amine;10-[2,6-bis(3-dibenzofuran-1-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]phenothiazine;10-[2,6-bis(1-phenylbenzimidazol-2-yl)-4-pyridinyl]-21,21-dimethyl-10,14-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;9-[2,6-bis(1-pyridin-4-ylbenzimidazol-2-yl)-4-pyridinyl]-3,6-dimethylcarbazole;10-[2,6-bis(3-pyridin-4-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]-9,9-dimethylacridine
SMILESCC1(C)c2ccccc2N(c2cc(-c3nc4cccnc4n3-c3ccncc3)nc(-c3nc4cccnc4n3-c3ccncc3)c2)c2ccccc21.CC1(C)c2ccccc2Nc2cc3c(cc21)c1ccccc1n3-c1cc(-c2nc3ccccc3n2-c2ccccc2)nc(-c2nc3ccccc3n2-c2ccccc2)c1.Cc1ccc2c(c1)c1cc(C)ccc1n2-c1cc(-c2nc3ccccc3n2-c2ccncc2)nc(-c2nc3ccccc3n2-c2ccncc2)c1.c1ccc(N(c2ccccc2)c2cc(-c3nc4cccnc4n3-c3cccc4[nH]c5ccccc5c34)nc(-c3nc4cccnc4n3-c3cccc4[nH]c5ccccc5c34)c2)cc1.c1ccc2c(c1)Sc1ccccc1N2c1cc(-c2nc3cccnc3n2-c2cccc3oc4ccccc4c23)nc(-c2nc3cccnc3n2-c2cccc3oc4ccccc4c23)c1
InChIInChI=1S/C53H34N10.C53H30N8O2S.C52H37N7.C43H30N8.C42H30N10/c1-3-15-33(16-4-1)61(34-17-5-2-6-18-34)35-31-44(52-59-42-25-13-29-54-50(42)62(52)46-27-11-23-40-48(46)36-19-7-9-21-38(36)56-40)58-45(32-35)53-60-43-26-14-30-55-51(43)63(53)47-28-12-24-41-49(47)37-20-8-10-22-39(37)57-41;1-5-21-42-32(13-1)48-40(19-9-23-44(48)62-42)60-50-34(15-11-27-54-50)57-52(60)36-29-31(59-38-17-3-7-25-46(38)64-47-26-8-4-18-39(47)59)30-37(56-36)53-58-35-16-12-28-55-51(35)61(53)41-20-10-24-45-49(41)33-14-2-6-22-43(33)63-45;1-52(2)38-22-10-11-23-40(38)53-43-32-49-37(31-39(43)52)36-21-9-14-26-46(36)57(49)35-29-44(50-55-41-24-12-15-27-47(41)58(50)33-17-5-3-6-18-33)54-45(30-35)51-56-42-25-13-16-28-48(42)59(51)34-19-7-4-8-20-34;1-27-11-13-38-32(23-27)33-24-28(2)12-14-39(33)49(38)31-25-36(42-47-34-7-3-5-9-40(34)50(42)29-15-19-44-20-16-29)46-37(26-31)43-48-35-8-4-6-10-41(35)51(43)30-17-21-45-22-18-30;1-42(2)30-9-3-5-13-36(30)50(37-14-6-4-10-31(37)42)29-25-34(40-48-32-11-7-19-45-38(32)51(40)27-15-21-43-22-16-27)47-35(26-29)41-49-33-12-8-20-46-39(33)52(41)28-17-23-44-24-18-28/h1-32,56-57H;1-30H;3-32,53H,1-2H3;3-26H,1-2H3;3-26H,1-2H3
InChIKeySCEYTCCUATYEMT-UHFFFAOYSA-N
XLogP57.19
TPSA461.02 Ų
H-Bond Donors3
H-Bond Acceptors44
Rotatable Bonds27
Heavy Atoms289
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003747.33
LogP ≤ 557.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1044

Analyze 2,6-bis[3-(9H-carbazol-4-yl)imidazo[4,5-b]pyridin-2-yl]-N,N-diphenylpyridin-4-amine;10-[2,6-bis(3-dibenzofuran-1-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]phenothiazine;10-[2,6-bis(1-phenylbenzimidazol-2-yl)-4-pyridinyl]-21,21-dimethyl-10,14-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;9-[2,6-bis(1-pyridin-4-ylbenzimidazol-2-yl)-4-pyridinyl]-3,6-dimethylcarbazole;10-[2,6-bis(3-pyridin-4-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]-9,9-dimethylacridine with MolForge

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Related Compounds

16-carbazol-9-yl-13,19-diaza-1-boranonacyclo[16.12.1.12,6.119,26.07,12.014,31.020,25.013,33.030,32]tritriaconta-2(33),3,5,7,9,11,14,16,18(31),20,22,24,26,28,30(32)-pentadecaene;10-(13,19-diaza-1-boranonacyclo[16.12.1.12,6.119,26.07,12.014,31.020,25.013,33.030,32]tritriaconta-2(33),3,5,7,9,11,14,16,18(31),20,22,24,26,28,30(32)-pentadecaen-16-yl)phenothiazine;10-(13,19-diaza-1-boranonacyclo[16.12.1.12,6.119,26.07,12.014,31.020,25.013,33.030,32]tritriaconta-2(33),3,5,7,9,11,14,16,18(31),20,22,24,26,28,30(32)-pentadecaen-16-yl)phenoxazine;16-(9,9-dimethylacridin-10-yl)-13,19-diaza-1-boranonacyclo[16.12.1.12,6.119,26.07,12.014,31.020,25.013,33.030,32]tritriaconta-2(33),3,5,7,9,11,14,16,18(31),20,22,24,26,28,30(32)-pentadecaene;N,N-diphenyl-13,19-diaza-1-boranonacyclo[16.12.1.12,6.119,26.07,12.014,31.020,25.013,33.030,32]tritriaconta-2(33),3,5,7,9,11,14,16,18(31),20,22,24,26,28,30(32)-pentadecaen-16-amine
CID 160511236
14,14-dimethyl-10-phenyl-21-[4-(1-phenylbenzimidazol-2-yl)phenyl]-10,21-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene
CID 66805197
6-(11H-[1]benzofuro[3,2-b]carbazol-8-yl)-1,3-diphenylquinazoline-2,4-dione;6-(10,16-dimethyl-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14(19),15,17-nonaen-5-yl)-1,3-diphenylquinazoline-2,4-dione;6-(7,7-dimethyl-5-phenylindeno[2,1-b]carbazol-2-yl)-1,3-diphenylquinazoline-2,4-dione;1,3-diphenyl-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]quinazoline-2,4-dione;6-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-1,3-diphenylquinazoline-2,4-dione;6-[3-(4-methyl-N-(4-methylphenyl)anilino)phenyl]-1,3-diphenylquinazoline-2,4-dione
CID 159162261
N-(4-carbazol-9-ylphenyl)-10-dibenzofuran-3-yl-N-naphthalen-2-ylphenoxazin-3-amine;10-dibenzofuran-3-yl-N-(9,9-dimethylfluoren-2-yl)-N-(3-phenylphenyl)phenoxazin-3-amine;10-dibenzofuran-3-yl-N-naphthalen-2-yl-N-(9-phenylcarbazol-2-yl)phenoxazin-3-amine
CID 165037780
5-(9-dibenzofuran-1-ylcarbazol-3-yl)indolo[2,3-b][1,5]naphthyridine
CID 146328956
2-(4-bromophenyl)-3-phenylimidazo[4,5-b]pyridine;9,9-dimethyl-10H-acridine;9,9-dimethyl-10-[4-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]acridine;pentane
CID 158552321
2-carbazol-9-yl-6-(9,9-dimethylacridin-10-yl)-N-(4-pyrazin-2-ylphenyl)-N-(4-pyrimidin-4-ylphenyl)pyridin-4-amine;2-carbazol-9-yl-6-phenothiazin-10-yl-N-(4-pyridin-2-ylphenyl)-N-(4-pyridin-4-ylphenyl)pyridin-4-amine;2-carbazol-9-yl-6-phenoxazin-10-yl-N-(4-pyridin-4-ylphenyl)-N-(4-pyrimidin-5-ylphenyl)pyridin-4-amine
CID 167567333
10-[3-[4-(N-dibenzofuran-3-yl-4-phenylanilino)phenyl]phenyl]acridin-9-one;10-[3-[4-(N-dibenzothiophen-3-yl-4-phenylanilino)phenyl]phenyl]acridin-9-one;N-[4-[3-(9,9-dimethylacridin-10-yl)phenyl]phenyl]-N-(4-phenylphenyl)dibenzofuran-3-amine;N-[4-[3-(9,9-dimethylacridin-10-yl)phenyl]phenyl]-N-(4-phenylphenyl)dibenzothiophen-3-amine;N-[4-(3-phenothiazin-10-ylphenyl)phenyl]-N-(4-phenylphenyl)dibenzofuran-3-amine;N-[4-(3-phenothiazin-10-ylphenyl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-3-amine;N-[4-(3-phenoxazin-10-ylphenyl)phenyl]-N-(4-phenylphenyl)dibenzofuran-3-amine;N-[4-(3-phenoxazin-10-ylphenyl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-3-amine
CID 161050395
9,9-dimethyl-10-phenyl-2-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]acridine;10-phenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]phenoxazine;10-phenyl-3-[9-phenyl-6-(10-phenylphenothiazin-3-yl)carbazol-3-yl]phenoxazine
CID 161400773
3-carbazol-9-yl-6,9-dimethylcarbazole;3-(3,6-dimethylcarbazol-9-yl)-10-methylphenothiazine;3-(3,6-dimethylcarbazol-9-yl)-10-methylphenoxazine;3,7-dimethyl-10-(9-methyl-6-phenoxazin-10-ylcarbazol-3-yl)phenoxazine;10-methyl-N-(4-methylphenyl)-N-phenylphenothiazin-3-amine;10-methyl-N-(4-methylphenyl)-N-phenylphenoxazin-3-amine;7,9,9,10-tetramethyl-N,N-diphenylacridin-2-amine;9,9,10-trimethyl-N-(4-methylphenyl)-N-phenylacridin-2-amine
CID 159629658
9,9-dimethyl-10-[3-(20-oxa-9-thiapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14,16,18-nonaen-4-yl)phenyl]acridine;9-[4-(20-oxa-9-thiapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14,16,18-nonaen-4-yl)phenyl]-3,6-diphenylcarbazole;10-[3-(20-oxa-9-thiapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14,16,18-nonaen-4-yl)phenyl]phenothiazine;10-[3-(20-oxa-9-thiapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14,16,18-nonaen-4-yl)phenyl]phenoxazine
CID 164954667
7-[4-[3-(9,9-dimethylacridin-10-yl)carbazol-9-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-b]indole
CID 165169056

Frequently Asked Questions

What is the IUPAC name of 2,6-bis[3-(9H-carbazol-4-yl)imidazo[4,5-b]pyridin-2-yl]-N,N-diphenylpyridin-4-amine;10-[2,6-bis(3-dibenzofuran-1-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]phenothiazine;10-[2,6-bis(1-phenylbenzimidazol-2-yl)-4-pyridinyl]-21,21-dimethyl-10,14-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;9-[2,6-bis(1-pyridin-4-ylbenzimidazol-2-yl)-4-pyridinyl]-3,6-dimethylcarbazole;10-[2,6-bis(3-pyridin-4-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]-9,9-dimethylacridine?
The IUPAC name of 2,6-bis[3-(9H-carbazol-4-yl)imidazo[4,5-b]pyridin-2-yl]-N,N-diphenylpyridin-4-amine;10-[2,6-bis(3-dibenzofuran-1-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]phenothiazine;10-[2,6-bis(1-phenylbenzimidazol-2-yl)-4-pyridinyl]-21,21-dimethyl-10,14-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;9-[2,6-bis(1-pyridin-4-ylbenzimidazol-2-yl)-4-pyridinyl]-3,6-dimethylcarbazole;10-[2,6-bis(3-pyridin-4-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]-9,9-dimethylacridine (CID 160794072) is 2,6-bis[3-(9H-carbazol-4-yl)imidazo[4,5-b]pyridin-2-yl]-N,N-diphenylpyridin-4-amine;10-[2,6-bis(3-dibenzofuran-1-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]phenothiazine;10-[2,6-bis(1-phenylbenzimidazol-2-yl)-4-pyridinyl]-21,21-dimethyl-10,14-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;9-[2,6-bis(1-pyridin-4-ylbenzimidazol-2-yl)-4-pyridinyl]-3,6-dimethylcarbazole;10-[2,6-bis(3-pyridin-4-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]-9,9-dimethylacridine.
What is the SMILES notation for 2,6-bis[3-(9H-carbazol-4-yl)imidazo[4,5-b]pyridin-2-yl]-N,N-diphenylpyridin-4-amine;10-[2,6-bis(3-dibenzofuran-1-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]phenothiazine;10-[2,6-bis(1-phenylbenzimidazol-2-yl)-4-pyridinyl]-21,21-dimethyl-10,14-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;9-[2,6-bis(1-pyridin-4-ylbenzimidazol-2-yl)-4-pyridinyl]-3,6-dimethylcarbazole;10-[2,6-bis(3-pyridin-4-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]-9,9-dimethylacridine?
The canonical SMILES for 2,6-bis[3-(9H-carbazol-4-yl)imidazo[4,5-b]pyridin-2-yl]-N,N-diphenylpyridin-4-amine;10-[2,6-bis(3-dibenzofuran-1-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]phenothiazine;10-[2,6-bis(1-phenylbenzimidazol-2-yl)-4-pyridinyl]-21,21-dimethyl-10,14-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;9-[2,6-bis(1-pyridin-4-ylbenzimidazol-2-yl)-4-pyridinyl]-3,6-dimethylcarbazole;10-[2,6-bis(3-pyridin-4-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]-9,9-dimethylacridine is CC1(C)c2ccccc2N(c2cc(-c3nc4cccnc4n3-c3ccncc3)nc(-c3nc4cccnc4n3-c3ccncc3)c2)c2ccccc21.CC1(C)c2ccccc2Nc2cc3c(cc21)c1ccccc1n3-c1cc(-c2nc3ccccc3n2-c2ccccc2)nc(-c2nc3ccccc3n2-c2ccccc2)c1.Cc1ccc2c(c1)c1cc(C)ccc1n2-c1cc(-c2nc3ccccc3n2-c2ccncc2)nc(-c2nc3ccccc3n2-c2ccncc2)c1.c1ccc(N(c2ccccc2)c2cc(-c3nc4cccnc4n3-c3cccc4[nH]c5ccccc5c34)nc(-c3nc4cccnc4n3-c3cccc4[nH]c5ccccc5c34)c2)cc1.c1ccc2c(c1)Sc1ccccc1N2c1cc(-c2nc3cccnc3n2-c2cccc3oc4ccccc4c23)nc(-c2nc3cccnc3n2-c2cccc3oc4ccccc4c23)c1.
What is the InChIKey of 2,6-bis[3-(9H-carbazol-4-yl)imidazo[4,5-b]pyridin-2-yl]-N,N-diphenylpyridin-4-amine;10-[2,6-bis(3-dibenzofuran-1-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]phenothiazine;10-[2,6-bis(1-phenylbenzimidazol-2-yl)-4-pyridinyl]-21,21-dimethyl-10,14-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;9-[2,6-bis(1-pyridin-4-ylbenzimidazol-2-yl)-4-pyridinyl]-3,6-dimethylcarbazole;10-[2,6-bis(3-pyridin-4-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]-9,9-dimethylacridine?
The InChIKey is SCEYTCCUATYEMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H34N10.C53H30N8O2S.C52H37N7.C43H30N8.C42H30N10/c1-3-15-33(16-4-1)61(34-17-5-2-6-18-34)35-31-44(52-59-42-25-13-29-54-50(42)62(52)46-27-11-23-40-48(46)36-19-7-9-21-38(36)56-40)58-45(32-35)53-60-43-26-14-30-55-51(43)63(53)47-28-12-24-41-49(47)37-20-8-10-22-39(37)57-41;1-5-21-42-32(13-1)48-40(19-9-23-44(48)62-42)60-50-34(15-11-27-54-50)57-52(60)36-29-31(59-38-17-3-7-25-46(38)64-47-26-8-4-18-39(47)59)30-37(56-36)53-58-35-16-12-28-55-51(35)61(53)41-20-10-24-45-49(41)33-14-2-6-22-43(33)63-45;1-52(2)38-22-10-11-23-40(38)53-43-32-49-37(31-39(43)52)36-21-9-14-26-46(36)57(49)35-29-44(50-55-41-24-12-15-27-47(41)58(50)33-17-5-3-6-18-33)54-45(30-35)51-56-42-25-13-16-28-48(42)59(51)34-19-7-4-8-20-34;1-27-11-13-38-32(23-27)33-24-28(2)12-14-39(33)49(38)31-25-36(42-47-34-7-3-5-9-40(34)50(42)29-15-19-44-20-16-29)46-37(26-31)43-48-35-8-4-6-10-41(35)51(43)30-17-21-45-22-18-30;1-42(2)30-9-3-5-13-36(30)50(37-14-6-4-10-31(37)42)29-25-34(40-48-32-11-7-19-45-38(32)51(40)27-15-21-43-22-16-27)47-35(26-29)41-49-33-12-8-20-46-39(33)52(41)28-17-23-44-24-18-28/h1-32,56-57H;1-30H;3-32,53H,1-2H3;3-26H,1-2H3;3-26H,1-2H3.
What are the key properties of 2,6-bis[3-(9H-carbazol-4-yl)imidazo[4,5-b]pyridin-2-yl]-N,N-diphenylpyridin-4-amine;10-[2,6-bis(3-dibenzofuran-1-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]phenothiazine;10-[2,6-bis(1-phenylbenzimidazol-2-yl)-4-pyridinyl]-21,21-dimethyl-10,14-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;9-[2,6-bis(1-pyridin-4-ylbenzimidazol-2-yl)-4-pyridinyl]-3,6-dimethylcarbazole;10-[2,6-bis(3-pyridin-4-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]-9,9-dimethylacridine?
2,6-bis[3-(9H-carbazol-4-yl)imidazo[4,5-b]pyridin-2-yl]-N,N-diphenylpyridin-4-amine;10-[2,6-bis(3-dibenzofuran-1-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]phenothiazine;10-[2,6-bis(1-phenylbenzimidazol-2-yl)-4-pyridinyl]-21,21-dimethyl-10,14-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;9-[2,6-bis(1-pyridin-4-ylbenzimidazol-2-yl)-4-pyridinyl]-3,6-dimethylcarbazole;10-[2,6-bis(3-pyridin-4-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]-9,9-dimethylacridine has a molecular weight of 3747.33 g/mol, XLogP of 57.19, 27 rotatable bonds, 3 hydrogen bond donors, and 44 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-bis[3-(9H-carbazol-4-yl)imidazo[4,5-b]pyridin-2-yl]-N,N-diphenylpyridin-4-amine;10-[2,6-bis(3-dibenzofuran-1-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]phenothiazine;10-[2,6-bis(1-phenylbenzimidazol-2-yl)-4-pyridinyl]-21,21-dimethyl-10,14-diazapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene;9-[2,6-bis(1-pyridin-4-ylbenzimidazol-2-yl)-4-pyridinyl]-3,6-dimethylcarbazole;10-[2,6-bis(3-pyridin-4-ylimidazo[4,5-b]pyridin-2-yl)-4-pyridinyl]-9,9-dimethylacridine is sourced from PubChem (CID 160794072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).