11,12-bis[6-(9H-acridin-10-yl)-2-pyridinyl]indolo[2,3-a]carbazole;10-[6-[12-(6-phenothiazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenothiazine;10-[6-[12-(6-phenoxazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenoxazine

C158H100N18O2S2 — CID 158181653

IUPAC11,12-bis[6-(9H-acridin-10-yl)-2-pyridinyl]indolo[2,3-a]carbazole;10-[6-[12-(6-phenothiazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenothiazine;10-[6-[12-(6-phenoxazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenoxazine
SMILESc1cc(N2c3ccccc3Cc3ccccc32)nc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5cccc(N6c7ccccc7Cc7ccccc76)n5)c4c32)c1.c1cc(N2c3ccccc3Oc3ccccc32)nc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5cccc(N6c7ccccc7Oc7ccccc76)n5)c4c32)c1.c1cc(N2c3ccccc3Sc3ccccc32)nc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5cccc(N6c7ccccc7Sc7ccccc76)n5)c4c32)c1
InChIInChI=1S/C54H36N6.C52H32N6O2.C52H32N6S2/c1-7-21-43-35(15-1)33-36-16-2-8-22-44(36)57(43)49-27-13-29-51(55-49)59-47-25-11-5-19-39(47)41-31-32-42-40-20-6-12-26-48(40)60(54(42)53(41)59)52-30-14-28-50(56-52)58-45-23-9-3-17-37(45)34-38-18-4-10-24-46(38)58;2*1-3-17-37-33(15-1)35-31-32-36-34-16-2-4-18-38(34)58(50-30-14-28-48(54-50)56-41-21-7-11-25-45(41)60-46-26-12-8-22-42(46)56)52(36)51(35)57(37)49-29-13-27-47(53-49)55-39-19-5-9-23-43(39)59-44-24-10-6-20-40(44)55/h1-32H,33-34H2;2*1-32H
InChIKeyFYQXWWDNBRNJPR-UHFFFAOYSA-N
MW2346.80 g/mol
LogP41.78
Rot. Bonds12

About 11,12-bis[6-(9H-acridin-10-yl)-2-pyridinyl]indolo[2,3-a]carbazole;10-[6-[12-(6-phenothiazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenothiazine;10-[6-[12-(6-phenoxazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenoxazine

11,12-bis[6-(9H-acridin-10-yl)-2-pyridinyl]indolo[2,3-a]carbazole;10-[6-[12-(6-phenothiazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenothiazine;10-[6-[12-(6-phenoxazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenoxazine (PubChem CID 158181653) has the molecular formula C158H100N18O2S2 and a molecular weight of 2346.80 g/mol. Its IUPAC name is 11,12-bis[6-(9H-acridin-10-yl)-2-pyridinyl]indolo[2,3-a]carbazole;10-[6-[12-(6-phenothiazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenothiazine;10-[6-[12-(6-phenoxazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenoxazine.

Molecular Properties

Compound Name11,12-bis[6-(9H-acridin-10-yl)-2-pyridinyl]indolo[2,3-a]carbazole;10-[6-[12-(6-phenothiazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenothiazine;10-[6-[12-(6-phenoxazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenoxazine
PubChem CID158181653
Molecular FormulaC158H100N18O2S2
Molecular Weight2346.80 g/mol
Exact Mass2344.77
IUPAC Name11,12-bis[6-(9H-acridin-10-yl)-2-pyridinyl]indolo[2,3-a]carbazole;10-[6-[12-(6-phenothiazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenothiazine;10-[6-[12-(6-phenoxazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenoxazine
SMILESc1cc(N2c3ccccc3Cc3ccccc32)nc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5cccc(N6c7ccccc7Cc7ccccc76)n5)c4c32)c1.c1cc(N2c3ccccc3Oc3ccccc32)nc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5cccc(N6c7ccccc7Oc7ccccc76)n5)c4c32)c1.c1cc(N2c3ccccc3Sc3ccccc32)nc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5cccc(N6c7ccccc7Sc7ccccc76)n5)c4c32)c1
InChIInChI=1S/C54H36N6.C52H32N6O2.C52H32N6S2/c1-7-21-43-35(15-1)33-36-16-2-8-22-44(36)57(43)49-27-13-29-51(55-49)59-47-25-11-5-19-39(47)41-31-32-42-40-20-6-12-26-48(40)60(54(42)53(41)59)52-30-14-28-50(56-52)58-45-23-9-3-17-37(45)34-38-18-4-10-24-46(38)58;2*1-3-17-37-33(15-1)35-31-32-36-34-16-2-4-18-38(34)58(50-30-14-28-48(54-50)56-41-21-7-11-25-45(41)60-46-26-12-8-22-42(46)56)52(36)51(35)57(37)49-29-13-27-47(53-49)55-39-19-5-9-23-43(39)59-44-24-10-6-20-40(44)55/h1-32H,33-34H2;2*1-32H
InChIKeyFYQXWWDNBRNJPR-UHFFFAOYSA-N
XLogP41.78
TPSA144.82 Ų
H-Bond Donors
H-Bond Acceptors22
Rotatable Bonds12
Heavy Atoms180
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002346.80
LogP ≤ 541.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1022

Analyze 11,12-bis[6-(9H-acridin-10-yl)-2-pyridinyl]indolo[2,3-a]carbazole;10-[6-[12-(6-phenothiazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenothiazine;10-[6-[12-(6-phenoxazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenoxazine with MolForge

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Related Compounds

12-(6-carbazol-9-yl-2-pyridinyl)-11-[6-(6-carbazol-9-yl-2-pyridinyl)-2-pyridinyl]indolo[2,3-a]carbazole
CID 58038308
butane;bis(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene);propane;bis(13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene)
CID 162109152
2-carbazol-9-ylisoindolo[2,3-a]benzimidazol-11-one;2-phenothiazin-10-ylisoindolo[2,3-a]benzimidazol-11-one;2-phenoxazin-10-ylisoindolo[2,3-a]benzimidazol-11-one
CID 158739311
12-(6-carbazol-9-yl-2-pyridinyl)-11-[3-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole
CID 118041124
7,10-bis(benzo[b][1]benzazepin-11-yl)pyrazino[2,3-f][1,10]phenanthroline;6,11-di(carbazol-9-yl)pyrazino[2,3-f][1,10]phenanthroline;bis(6,11-dihydro-5H-benzo[b][1]benzazepine);2,3-dipyridin-3-ylpyrazine;10-(6-phenothiazin-10-ylpyrazino[2,3-f][1,10]phenanthrolin-11-yl)phenothiazine;10-(6-phenoxazin-10-ylpyrazino[2,3-f][1,10]phenanthrolin-11-yl)phenoxazine;6-N,6-N,11-N,11-N-tetraphenylpyrazino[2,3-f][1,10]phenanthroline-6,11-diamine
CID 165077203
1-carbazol-9-yl-10-phenylphenoxazine
CID 175123685
3,7-di(carbazol-9-yl)-10-[7-[3,7-di(carbazol-9-yl)phenoxazin-10-yl]pyrazino[2,3-f][1,10]phenanthrolin-10-yl]phenoxazine
CID 129089164
10-carbazol-9-yl-5-naphthalen-2-ylbenzo[g]isoquinoline;10-(9,9-dimethylacridin-10-yl)-5-naphthalen-2-ylbenzo[g]isoquinoline;10,10-dimethyl-5-(5-naphthalen-2-ylbenzo[g]isoquinolin-10-yl)benzo[b][1,4]benzazasiline;11-(5-naphthalen-2-ylbenzo[g]isoquinolin-10-yl)-5,6-dihydrobenzo[b][1]benzazepine;10-(5-naphthalen-2-ylbenzo[g]isoquinolin-10-yl)phenothiazine;10-(5-naphthalen-2-ylbenzo[g]isoquinolin-10-yl)phenoxazine
CID 157239735
5-carbazol-9-yl-10-naphthalen-2-ylbenzo[g]quinoline;5-(9,9-dimethylacridin-10-yl)-10-naphthalen-2-ylbenzo[g]quinoline;10,10-dimethyl-5-(10-naphthalen-2-ylbenzo[g]quinolin-5-yl)benzo[b][1,4]benzazasiline;11-(10-naphthalen-2-ylbenzo[g]quinolin-5-yl)-5,6-dihydrobenzo[b][1]benzazepine;10-(10-naphthalen-2-ylbenzo[g]quinolin-5-yl)phenothiazine;10-(10-naphthalen-2-ylbenzo[g]quinolin-5-yl)phenoxazine
CID 160899758
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
spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,9'-xanthene]
CID 135140118
14-azaheptacyclo[12.10.1.13,24.02,7.08,13.015,20.021,25]hexacosa-1(24),2,4,6,8,10,12,15,17,19,21(25),22-dodecaene
CID 162093408

Frequently Asked Questions

What is the IUPAC name of 11,12-bis[6-(9H-acridin-10-yl)-2-pyridinyl]indolo[2,3-a]carbazole;10-[6-[12-(6-phenothiazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenothiazine;10-[6-[12-(6-phenoxazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenoxazine?
The IUPAC name of 11,12-bis[6-(9H-acridin-10-yl)-2-pyridinyl]indolo[2,3-a]carbazole;10-[6-[12-(6-phenothiazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenothiazine;10-[6-[12-(6-phenoxazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenoxazine (CID 158181653) is 11,12-bis[6-(9H-acridin-10-yl)-2-pyridinyl]indolo[2,3-a]carbazole;10-[6-[12-(6-phenothiazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenothiazine;10-[6-[12-(6-phenoxazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenoxazine.
What is the SMILES notation for 11,12-bis[6-(9H-acridin-10-yl)-2-pyridinyl]indolo[2,3-a]carbazole;10-[6-[12-(6-phenothiazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenothiazine;10-[6-[12-(6-phenoxazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenoxazine?
The canonical SMILES for 11,12-bis[6-(9H-acridin-10-yl)-2-pyridinyl]indolo[2,3-a]carbazole;10-[6-[12-(6-phenothiazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenothiazine;10-[6-[12-(6-phenoxazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenoxazine is c1cc(N2c3ccccc3Cc3ccccc32)nc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5cccc(N6c7ccccc7Cc7ccccc76)n5)c4c32)c1.c1cc(N2c3ccccc3Oc3ccccc32)nc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5cccc(N6c7ccccc7Oc7ccccc76)n5)c4c32)c1.c1cc(N2c3ccccc3Sc3ccccc32)nc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5cccc(N6c7ccccc7Sc7ccccc76)n5)c4c32)c1.
What is the InChIKey of 11,12-bis[6-(9H-acridin-10-yl)-2-pyridinyl]indolo[2,3-a]carbazole;10-[6-[12-(6-phenothiazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenothiazine;10-[6-[12-(6-phenoxazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenoxazine?
The InChIKey is FYQXWWDNBRNJPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H36N6.C52H32N6O2.C52H32N6S2/c1-7-21-43-35(15-1)33-36-16-2-8-22-44(36)57(43)49-27-13-29-51(55-49)59-47-25-11-5-19-39(47)41-31-32-42-40-20-6-12-26-48(40)60(54(42)53(41)59)52-30-14-28-50(56-52)58-45-23-9-3-17-37(45)34-38-18-4-10-24-46(38)58;2*1-3-17-37-33(15-1)35-31-32-36-34-16-2-4-18-38(34)58(50-30-14-28-48(54-50)56-41-21-7-11-25-45(41)60-46-26-12-8-22-42(46)56)52(36)51(35)57(37)49-29-13-27-47(53-49)55-39-19-5-9-23-43(39)59-44-24-10-6-20-40(44)55/h1-32H,33-34H2;2*1-32H.
What are the key properties of 11,12-bis[6-(9H-acridin-10-yl)-2-pyridinyl]indolo[2,3-a]carbazole;10-[6-[12-(6-phenothiazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenothiazine;10-[6-[12-(6-phenoxazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenoxazine?
11,12-bis[6-(9H-acridin-10-yl)-2-pyridinyl]indolo[2,3-a]carbazole;10-[6-[12-(6-phenothiazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenothiazine;10-[6-[12-(6-phenoxazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenoxazine has a molecular weight of 2346.80 g/mol, XLogP of 41.78, 12 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 11,12-bis[6-(9H-acridin-10-yl)-2-pyridinyl]indolo[2,3-a]carbazole;10-[6-[12-(6-phenothiazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenothiazine;10-[6-[12-(6-phenoxazin-10-yl-2-pyridinyl)indolo[2,3-a]carbazol-11-yl]-2-pyridinyl]phenoxazine is sourced from PubChem (CID 158181653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).