2,5-bis([1]benzothiolo[2,3-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[2,3-b]carbazol-7-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-b]carbazol-11-yl)-4-isocyanobenzonitrile;4-isocyano-2,5-bis(11-phenylindolo[2,3-a]carbazol-12-yl)benzonitrile;4-isocyano-2,5-bis(5-phenylindolo[3,2-c]carbazol-12-yl)benzonitrile

C288H152N28S8 — CID 157441006

IUPAC2,5-bis([1]benzothiolo[2,3-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[2,3-b]carbazol-7-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-b]carbazol-11-yl)-4-isocyanobenzonitrile;4-isocyano-2,5-bis(11-phenylindolo[2,3-a]carbazol-12-yl)benzonitrile;4-isocyano-2,5-bis(5-phenylindolo[3,2-c]carbazol-12-yl)benzonitrile
SMILES[C-]#[N+]c1cc(-n2c3ccccc3c3cc4c(cc32)sc2ccccc24)c(C#N)cc1-n1c2ccccc2c2cc3c(cc21)sc1ccccc13.[C-]#[N+]c1cc(-n2c3ccccc3c3cc4sc5ccccc5c4cc32)c(C#N)cc1-n1c2ccccc2c2cc3sc4ccccc4c3cc21.[C-]#[N+]c1cc(-n2c3ccccc3c3ccc4c(c5ccccc5n4-c4ccccc4)c32)c(C#N)cc1-n1c2ccccc2c2ccc3c(c4ccccc4n3-c3ccccc3)c21.[C-]#[N+]c1cc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5ccccc5)c4c32)c(C#N)cc1-n1c2ccccc2c2ccc3c4ccccc4n(-c4ccccc4)c3c21.[C-]#[N+]c1cc(-n2c3ccccc3c3ccc4c5ccccc5sc4c32)c(C#N)cc1-n1c2ccccc2c2ccc3c4ccccc4sc3c21.[C-]#[N+]c1cc(-n2c3ccccc3c3ccc4sc5ccccc5c4c32)c(C#N)cc1-n1c2ccccc2c2ccc3sc4ccccc4c3c21
InChIInChI=1S/2C56H32N6.4C44H22N4S2/c1-58-44-33-51(61-45-24-12-8-20-38(45)40-28-30-49-53(55(40)61)42-22-10-14-26-47(42)59(49)36-16-4-2-5-17-36)35(34-57)32-52(44)62-46-25-13-9-21-39(46)41-29-31-50-54(56(41)62)43-23-11-15-27-48(43)60(50)37-18-6-3-7-19-37;1-58-46-33-51(61-49-26-14-10-22-40(49)44-30-28-42-38-20-8-12-24-47(38)59(53(42)55(44)61)36-16-4-2-5-17-36)35(34-57)32-52(46)62-50-27-15-11-23-41(50)45-31-29-43-39-21-9-13-25-48(39)60(54(43)56(45)62)37-18-6-3-7-19-37;1-46-34-23-37(47-35-14-6-2-10-26(35)30-21-43-32(19-38(30)47)28-12-4-8-16-41(28)49-43)25(24-45)18-40(34)48-36-15-7-3-11-27(36)31-22-44-33(20-39(31)48)29-13-5-9-17-42(29)50-44;1-46-34-21-37(47-35-14-6-2-10-26(35)30-19-32-28-12-4-8-16-41(28)49-43(32)22-38(30)47)25(24-45)18-40(34)48-36-15-7-3-11-27(36)31-20-33-29-13-5-9-17-42(29)50-44(33)23-39(31)48;1-46-32-23-35(47-33-14-6-2-10-26(33)28-18-20-39-41(43(28)47)30-12-4-8-16-37(30)49-39)25(24-45)22-36(32)48-34-15-7-3-11-27(34)29-19-21-40-42(44(29)48)31-13-5-9-17-38(31)50-40;1-46-34-23-37(47-35-14-6-2-10-26(35)30-18-20-32-28-12-4-8-16-39(28)49-43(32)41(30)47)25(24-45)22-38(34)48-36-15-7-3-11-27(36)31-19-21-33-29-13-5-9-17-40(29)50-44(33)42(31)48/h2*2-33H;4*2-23H
InChIKeyBRRBGKFFXMZLDH-UHFFFAOYSA-N
MW4261.12 g/mol
LogP81.15
Rot. Bonds16

About 2,5-bis([1]benzothiolo[2,3-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[2,3-b]carbazol-7-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-b]carbazol-11-yl)-4-isocyanobenzonitrile;4-isocyano-2,5-bis(11-phenylindolo[2,3-a]carbazol-12-yl)benzonitrile;4-isocyano-2,5-bis(5-phenylindolo[3,2-c]carbazol-12-yl)benzonitrile

2,5-bis([1]benzothiolo[2,3-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[2,3-b]carbazol-7-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-b]carbazol-11-yl)-4-isocyanobenzonitrile;4-isocyano-2,5-bis(11-phenylindolo[2,3-a]carbazol-12-yl)benzonitrile;4-isocyano-2,5-bis(5-phenylindolo[3,2-c]carbazol-12-yl)benzonitrile (PubChem CID 157441006) has the molecular formula C288H152N28S8 and a molecular weight of 4261.12 g/mol. Its IUPAC name is 2,5-bis([1]benzothiolo[2,3-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[2,3-b]carbazol-7-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-b]carbazol-11-yl)-4-isocyanobenzonitrile;4-isocyano-2,5-bis(11-phenylindolo[2,3-a]carbazol-12-yl)benzonitrile;4-isocyano-2,5-bis(5-phenylindolo[3,2-c]carbazol-12-yl)benzonitrile.

Molecular Properties

Compound Name2,5-bis([1]benzothiolo[2,3-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[2,3-b]carbazol-7-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-b]carbazol-11-yl)-4-isocyanobenzonitrile;4-isocyano-2,5-bis(11-phenylindolo[2,3-a]carbazol-12-yl)benzonitrile;4-isocyano-2,5-bis(5-phenylindolo[3,2-c]carbazol-12-yl)benzonitrile
PubChem CID157441006
Molecular FormulaC288H152N28S8
Molecular Weight4261.12 g/mol
Exact Mass4257.05
IUPAC Name2,5-bis([1]benzothiolo[2,3-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[2,3-b]carbazol-7-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-b]carbazol-11-yl)-4-isocyanobenzonitrile;4-isocyano-2,5-bis(11-phenylindolo[2,3-a]carbazol-12-yl)benzonitrile;4-isocyano-2,5-bis(5-phenylindolo[3,2-c]carbazol-12-yl)benzonitrile
SMILES[C-]#[N+]c1cc(-n2c3ccccc3c3cc4c(cc32)sc2ccccc24)c(C#N)cc1-n1c2ccccc2c2cc3c(cc21)sc1ccccc13.[C-]#[N+]c1cc(-n2c3ccccc3c3cc4sc5ccccc5c4cc32)c(C#N)cc1-n1c2ccccc2c2cc3sc4ccccc4c3cc21.[C-]#[N+]c1cc(-n2c3ccccc3c3ccc4c(c5ccccc5n4-c4ccccc4)c32)c(C#N)cc1-n1c2ccccc2c2ccc3c(c4ccccc4n3-c3ccccc3)c21.[C-]#[N+]c1cc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5ccccc5)c4c32)c(C#N)cc1-n1c2ccccc2c2ccc3c4ccccc4n(-c4ccccc4)c3c21.[C-]#[N+]c1cc(-n2c3ccccc3c3ccc4c5ccccc5sc4c32)c(C#N)cc1-n1c2ccccc2c2ccc3c4ccccc4sc3c21.[C-]#[N+]c1cc(-n2c3ccccc3c3ccc4sc5ccccc5c4c32)c(C#N)cc1-n1c2ccccc2c2ccc3sc4ccccc4c3c21
InChIInChI=1S/2C56H32N6.4C44H22N4S2/c1-58-44-33-51(61-45-24-12-8-20-38(45)40-28-30-49-53(55(40)61)42-22-10-14-26-47(42)59(49)36-16-4-2-5-17-36)35(34-57)32-52(44)62-46-25-13-9-21-39(46)41-29-31-50-54(56(41)62)43-23-11-15-27-48(43)60(50)37-18-6-3-7-19-37;1-58-46-33-51(61-49-26-14-10-22-40(49)44-30-28-42-38-20-8-12-24-47(38)59(53(42)55(44)61)36-16-4-2-5-17-36)35(34-57)32-52(46)62-50-27-15-11-23-41(50)45-31-29-43-39-21-9-13-25-48(39)60(54(43)56(45)62)37-18-6-3-7-19-37;1-46-34-23-37(47-35-14-6-2-10-26(35)30-21-43-32(19-38(30)47)28-12-4-8-16-41(28)49-43)25(24-45)18-40(34)48-36-15-7-3-11-27(36)31-22-44-33(20-39(31)48)29-13-5-9-17-42(29)50-44;1-46-34-21-37(47-35-14-6-2-10-26(35)30-19-32-28-12-4-8-16-41(28)49-43(32)22-38(30)47)25(24-45)18-40(34)48-36-15-7-3-11-27(36)31-20-33-29-13-5-9-17-42(29)50-44(33)23-39(31)48;1-46-32-23-35(47-33-14-6-2-10-26(33)28-18-20-39-41(43(28)47)30-12-4-8-16-37(30)49-39)25(24-45)22-36(32)48-34-15-7-3-11-27(34)29-19-21-40-42(44(29)48)31-13-5-9-17-38(31)50-40;1-46-34-23-37(47-35-14-6-2-10-26(35)30-18-20-32-28-12-4-8-16-39(28)49-43(32)41(30)47)25(24-45)22-38(34)48-36-15-7-3-11-27(36)31-19-21-33-29-13-5-9-17-40(29)50-44(33)42(31)48/h2*2-33H;4*2-23H
InChIKeyBRRBGKFFXMZLDH-UHFFFAOYSA-N
XLogP81.15
TPSA247.78 Ų
H-Bond Donors
H-Bond Acceptors30
Rotatable Bonds16
Heavy Atoms324
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004261.12
LogP ≤ 581.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1030

Analyze 2,5-bis([1]benzothiolo[2,3-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[2,3-b]carbazol-7-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-b]carbazol-11-yl)-4-isocyanobenzonitrile;4-isocyano-2,5-bis(11-phenylindolo[2,3-a]carbazol-12-yl)benzonitrile;4-isocyano-2,5-bis(5-phenylindolo[3,2-c]carbazol-12-yl)benzonitrile with MolForge

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Related Compounds

2-(10-carbazol-9-yl-[1]benzothiolo[2,3-b]carbazol-7-yl)-5-(3-carbazol-9-yl-11-phenylindolo[2,3-a]carbazol-12-yl)-4-isocyanobenzonitrile
CID 153462633
5-([1]benzothiolo[2,3-a]carbazol-12-yl)-4-isocyano-2-(10-phenylbenzo[c]carbazol-7-yl)benzonitrile;5-([1]benzothiolo[3,2-a]carbazol-12-yl)-4-isocyano-2-(10-phenylbenzo[c]carbazol-7-yl)benzonitrile;5-([1]benzothiolo[2,3-b]carbazol-7-yl)-4-isocyano-2-(10-phenylbenzo[c]carbazol-7-yl)benzonitrile
CID 158697678
4-isocyano-2,5-bis(12-phenyl-12,15-diazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaen-15-yl)benzonitrile;4-isocyano-2,5-bis(12-phenyl-12,16-diazahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(13),2(11),3,5,7,9,14,17,19,21,23-undecaen-16-yl)benzonitrile;4-isocyano-2,5-bis(12-thia-22-azahexacyclo[11.11.0.02,11.03,8.015,23.016,21]tetracosa-1(24),2(11),3,5,7,9,13,15(23),16,18,20-undecaen-22-yl)benzonitrile;4-isocyano-2,5-bis(12-thia-23-azahexacyclo[11.11.0.02,11.03,8.016,24.017,22]tetracosa-1(13),2(11),3,5,7,9,14,16(24),17,19,21-undecaen-23-yl)benzonitrile
CID 161262791
2,5-bis(8-carbazol-9-yl-[1]benzothiolo[2,3-b]carbazol-7-yl)-4-isocyanobenzonitrile
CID 153462324
4-isocyano-2,5-bis(5-phenylindolo[3,2-c]carbazol-12-yl)benzonitrile
CID 153461944
2,5-bis([1]benzothiolo[2,3-a]carbazol-12-yl)-4-isocyanobenzonitrile
CID 153462196
4-isocyano-2,5-bis(9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)benzonitrile
CID 153461967
5-carbazol-9-yl-2-[2-isocyano-4-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]benzonitrile;5-carbazol-9-yl-2-[2-isocyano-4-(9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]benzonitrile
CID 163487766
2,5-bis([1]benzothiolo[2,3-a]carbazol-12-yl)-3,6-di(carbazol-9-yl)benzene-1,4-dicarbonitrile;2,5-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-3,6-di(carbazol-9-yl)benzene-1,4-dicarbonitrile;2,5-bis([1]benzothiolo[3,2-b]carbazol-11-yl)-3,6-di(carbazol-9-yl)benzene-1,4-dicarbonitrile
CID 158184322
5-benzo[c]carbazol-7-yl-2-(10-carbazol-9-ylbenzo[c]carbazol-7-yl)-4-isocyanobenzonitrile;5-benzo[c]carbazol-7-yl-2-(11-carbazol-9-ylbenzo[c]carbazol-7-yl)-4-isocyanobenzonitrile;5-benzo[c]carbazol-7-yl-4-isocyano-2-(11-phenylindolo[2,3-a]carbazol-12-yl)benzonitrile;5-benzo[c]carbazol-7-yl-4-isocyano-2-(5-phenylindolo[3,2-b]carbazol-11-yl)benzonitrile;5-benzo[c]carbazol-7-yl-4-isocyano-2-(7-phenylindolo[2,3-b]carbazol-5-yl)benzonitrile;5-benzo[c]carbazol-7-yl-4-isocyano-2-(5-phenylindolo[3,2-c]carbazol-12-yl)benzonitrile;5-benzo[c]carbazol-7-yl-4-isocyano-2-(12-phenylindolo[3,2-c]carbazol-5-yl)benzonitrile
CID 159006243
5-([1]benzothiolo[3,2-a]carbazol-12-yl)-4-isocyano-2-(10-phenylbenzo[c]carbazol-7-yl)benzonitrile
CID 153462620
2,5-bis(4-carbazol-9-yl-11-phenylindolo[3,2-b]carbazol-5-yl)-4-isocyanobenzonitrile
CID 153461983

Frequently Asked Questions

What is the IUPAC name of 2,5-bis([1]benzothiolo[2,3-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[2,3-b]carbazol-7-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-b]carbazol-11-yl)-4-isocyanobenzonitrile;4-isocyano-2,5-bis(11-phenylindolo[2,3-a]carbazol-12-yl)benzonitrile;4-isocyano-2,5-bis(5-phenylindolo[3,2-c]carbazol-12-yl)benzonitrile?
The IUPAC name of 2,5-bis([1]benzothiolo[2,3-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[2,3-b]carbazol-7-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-b]carbazol-11-yl)-4-isocyanobenzonitrile;4-isocyano-2,5-bis(11-phenylindolo[2,3-a]carbazol-12-yl)benzonitrile;4-isocyano-2,5-bis(5-phenylindolo[3,2-c]carbazol-12-yl)benzonitrile (CID 157441006) is 2,5-bis([1]benzothiolo[2,3-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[2,3-b]carbazol-7-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-b]carbazol-11-yl)-4-isocyanobenzonitrile;4-isocyano-2,5-bis(11-phenylindolo[2,3-a]carbazol-12-yl)benzonitrile;4-isocyano-2,5-bis(5-phenylindolo[3,2-c]carbazol-12-yl)benzonitrile.
What is the SMILES notation for 2,5-bis([1]benzothiolo[2,3-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[2,3-b]carbazol-7-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-b]carbazol-11-yl)-4-isocyanobenzonitrile;4-isocyano-2,5-bis(11-phenylindolo[2,3-a]carbazol-12-yl)benzonitrile;4-isocyano-2,5-bis(5-phenylindolo[3,2-c]carbazol-12-yl)benzonitrile?
The canonical SMILES for 2,5-bis([1]benzothiolo[2,3-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[2,3-b]carbazol-7-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-b]carbazol-11-yl)-4-isocyanobenzonitrile;4-isocyano-2,5-bis(11-phenylindolo[2,3-a]carbazol-12-yl)benzonitrile;4-isocyano-2,5-bis(5-phenylindolo[3,2-c]carbazol-12-yl)benzonitrile is [C-]#[N+]c1cc(-n2c3ccccc3c3cc4c(cc32)sc2ccccc24)c(C#N)cc1-n1c2ccccc2c2cc3c(cc21)sc1ccccc13.[C-]#[N+]c1cc(-n2c3ccccc3c3cc4sc5ccccc5c4cc32)c(C#N)cc1-n1c2ccccc2c2cc3sc4ccccc4c3cc21.[C-]#[N+]c1cc(-n2c3ccccc3c3ccc4c(c5ccccc5n4-c4ccccc4)c32)c(C#N)cc1-n1c2ccccc2c2ccc3c(c4ccccc4n3-c3ccccc3)c21.[C-]#[N+]c1cc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5ccccc5)c4c32)c(C#N)cc1-n1c2ccccc2c2ccc3c4ccccc4n(-c4ccccc4)c3c21.[C-]#[N+]c1cc(-n2c3ccccc3c3ccc4c5ccccc5sc4c32)c(C#N)cc1-n1c2ccccc2c2ccc3c4ccccc4sc3c21.[C-]#[N+]c1cc(-n2c3ccccc3c3ccc4sc5ccccc5c4c32)c(C#N)cc1-n1c2ccccc2c2ccc3sc4ccccc4c3c21.
What is the InChIKey of 2,5-bis([1]benzothiolo[2,3-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[2,3-b]carbazol-7-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-b]carbazol-11-yl)-4-isocyanobenzonitrile;4-isocyano-2,5-bis(11-phenylindolo[2,3-a]carbazol-12-yl)benzonitrile;4-isocyano-2,5-bis(5-phenylindolo[3,2-c]carbazol-12-yl)benzonitrile?
The InChIKey is BRRBGKFFXMZLDH-UHFFFAOYSA-N. The full InChI is InChI=1S/2C56H32N6.4C44H22N4S2/c1-58-44-33-51(61-45-24-12-8-20-38(45)40-28-30-49-53(55(40)61)42-22-10-14-26-47(42)59(49)36-16-4-2-5-17-36)35(34-57)32-52(44)62-46-25-13-9-21-39(46)41-29-31-50-54(56(41)62)43-23-11-15-27-48(43)60(50)37-18-6-3-7-19-37;1-58-46-33-51(61-49-26-14-10-22-40(49)44-30-28-42-38-20-8-12-24-47(38)59(53(42)55(44)61)36-16-4-2-5-17-36)35(34-57)32-52(46)62-50-27-15-11-23-41(50)45-31-29-43-39-21-9-13-25-48(39)60(54(43)56(45)62)37-18-6-3-7-19-37;1-46-34-23-37(47-35-14-6-2-10-26(35)30-21-43-32(19-38(30)47)28-12-4-8-16-41(28)49-43)25(24-45)18-40(34)48-36-15-7-3-11-27(36)31-22-44-33(20-39(31)48)29-13-5-9-17-42(29)50-44;1-46-34-21-37(47-35-14-6-2-10-26(35)30-19-32-28-12-4-8-16-41(28)49-43(32)22-38(30)47)25(24-45)18-40(34)48-36-15-7-3-11-27(36)31-20-33-29-13-5-9-17-42(29)50-44(33)23-39(31)48;1-46-32-23-35(47-33-14-6-2-10-26(33)28-18-20-39-41(43(28)47)30-12-4-8-16-37(30)49-39)25(24-45)22-36(32)48-34-15-7-3-11-27(34)29-19-21-40-42(44(29)48)31-13-5-9-17-38(31)50-40;1-46-34-23-37(47-35-14-6-2-10-26(35)30-18-20-32-28-12-4-8-16-39(28)49-43(32)41(30)47)25(24-45)22-38(34)48-36-15-7-3-11-27(36)31-19-21-33-29-13-5-9-17-40(29)50-44(33)42(31)48/h2*2-33H;4*2-23H.
What are the key properties of 2,5-bis([1]benzothiolo[2,3-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[2,3-b]carbazol-7-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-b]carbazol-11-yl)-4-isocyanobenzonitrile;4-isocyano-2,5-bis(11-phenylindolo[2,3-a]carbazol-12-yl)benzonitrile;4-isocyano-2,5-bis(5-phenylindolo[3,2-c]carbazol-12-yl)benzonitrile?
2,5-bis([1]benzothiolo[2,3-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[2,3-b]carbazol-7-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-b]carbazol-11-yl)-4-isocyanobenzonitrile;4-isocyano-2,5-bis(11-phenylindolo[2,3-a]carbazol-12-yl)benzonitrile;4-isocyano-2,5-bis(5-phenylindolo[3,2-c]carbazol-12-yl)benzonitrile has a molecular weight of 4261.12 g/mol, XLogP of 81.15, 16 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-bis([1]benzothiolo[2,3-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[2,3-b]carbazol-7-yl)-4-isocyanobenzonitrile;2,5-bis([1]benzothiolo[3,2-b]carbazol-11-yl)-4-isocyanobenzonitrile;4-isocyano-2,5-bis(11-phenylindolo[2,3-a]carbazol-12-yl)benzonitrile;4-isocyano-2,5-bis(5-phenylindolo[3,2-c]carbazol-12-yl)benzonitrile is sourced from PubChem (CID 157441006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).