2-[2-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[2-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole

C206H128N12S4 — CID 159144378

IUPAC2-[2-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[2-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cc(-c6nc7ccccc7s6)c6ccccc6c5)ccc43)cc2)cc1.c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccc(-c6nc7ccccc7s6)c6ccccc56)ccc43)cc2)cc1.c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccc6ccccc6c5-c5nc6ccccc6s5)ccc43)cc2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5ccccc5c4-c4nc5ccccc5s4)ccc32)cc1
InChIInChI=1S/3C53H33N3S.C47H29N3S/c1-2-12-34(13-3-1)35-22-27-39(28-23-35)55-46-19-9-6-16-41(46)43-32-37(25-29-48(43)55)38-26-30-49-44(33-38)42-17-7-10-20-47(42)56(49)50-31-24-36-14-4-5-15-40(36)52(50)53-54-45-18-8-11-21-51(45)57-53;1-2-12-34(13-3-1)35-22-26-38(27-23-35)55-47-19-9-6-16-41(47)44-32-36(24-29-50(44)55)37-25-30-51-45(33-37)42-17-7-10-20-48(42)56(51)49-31-28-43(39-14-4-5-15-40(39)49)53-54-46-18-8-11-21-52(46)57-53;1-2-12-34(13-3-1)35-22-26-39(27-23-35)55-48-19-9-6-16-42(48)44-31-36(24-28-50(44)55)37-25-29-51-45(32-37)43-17-7-10-20-49(43)56(51)40-30-38-14-4-5-15-41(38)46(33-40)53-54-47-18-8-11-21-52(47)57-53;1-2-13-33(14-3-1)49-40-19-9-6-16-35(40)37-28-31(23-25-42(37)49)32-24-26-43-38(29-32)36-17-7-10-20-41(36)50(43)44-27-22-30-12-4-5-15-34(30)46(44)47-48-39-18-8-11-21-45(39)51-47/h3*1-33H;1-29H
InChIKeyKIMMYPBUAYCCFT-UHFFFAOYSA-N
MW2899.64 g/mol
LogP56.91
Rot. Bonds19

About 2-[2-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[2-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole

2-[2-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[2-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole (PubChem CID 159144378) has the molecular formula C206H128N12S4 and a molecular weight of 2899.64 g/mol. Its IUPAC name is 2-[2-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[2-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole.

Molecular Properties

Compound Name2-[2-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[2-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole
PubChem CID159144378
Molecular FormulaC206H128N12S4
Molecular Weight2899.64 g/mol
Exact Mass2896.93
IUPAC Name2-[2-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[2-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cc(-c6nc7ccccc7s6)c6ccccc6c5)ccc43)cc2)cc1.c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccc(-c6nc7ccccc7s6)c6ccccc56)ccc43)cc2)cc1.c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccc6ccccc6c5-c5nc6ccccc6s5)ccc43)cc2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5ccccc5c4-c4nc5ccccc5s4)ccc32)cc1
InChIInChI=1S/3C53H33N3S.C47H29N3S/c1-2-12-34(13-3-1)35-22-27-39(28-23-35)55-46-19-9-6-16-41(46)43-32-37(25-29-48(43)55)38-26-30-49-44(33-38)42-17-7-10-20-47(42)56(49)50-31-24-36-14-4-5-15-40(36)52(50)53-54-45-18-8-11-21-51(45)57-53;1-2-12-34(13-3-1)35-22-26-38(27-23-35)55-47-19-9-6-16-41(47)44-32-36(24-29-50(44)55)37-25-30-51-45(33-37)42-17-7-10-20-48(42)56(51)49-31-28-43(39-14-4-5-15-40(39)49)53-54-46-18-8-11-21-52(46)57-53;1-2-12-34(13-3-1)35-22-26-39(27-23-35)55-48-19-9-6-16-42(48)44-31-36(24-28-50(44)55)37-25-29-51-45(32-37)43-17-7-10-20-49(43)56(51)40-30-38-14-4-5-15-41(38)46(33-40)53-54-47-18-8-11-21-52(47)57-53;1-2-13-33(14-3-1)49-40-19-9-6-16-35(40)37-28-31(23-25-42(37)49)32-24-26-43-38(29-32)36-17-7-10-20-41(36)50(43)44-27-22-30-12-4-5-15-34(30)46(44)47-48-39-18-8-11-21-45(39)51-47/h3*1-33H;1-29H
InChIKeyKIMMYPBUAYCCFT-UHFFFAOYSA-N
XLogP56.91
TPSA91.00 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds19
Heavy Atoms222
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002899.64
LogP ≤ 556.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Analyze 2-[2-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[2-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole with MolForge

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Related Compounds

2-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]-1,3-benzothiazole;2-[4-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]-1,3-benzothiazole;2-(2-spiro[fluorene-9,11'-indeno[1,2-b]carbazole]-5'-ylnaphthalen-1-yl)-1,3-benzothiazole;2-(3-spiro[fluorene-9,11'-indeno[1,2-b]carbazole]-5'-ylnaphthalen-1-yl)-1,3-benzothiazole
CID 159048482
2-[2-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]-1,3-benzothiazole;2-[2-[5-(4-phenylphenyl)indolo[3,2-b]carbazol-11-yl]phenyl]-1,3-benzothiazole;2-[3-[5-(4-phenylphenyl)indolo[3,2-b]carbazol-11-yl]phenyl]-1,3-benzothiazole;2-[4-[5-(4-phenylphenyl)indolo[3,2-b]carbazol-11-yl]phenyl]-1,3-benzothiazole;2-[4-[11-(3-phenylphenyl)indolo[3,2-b]carbazol-5-yl]phenyl]-1,3-benzothiazole
CID 160868466
2-[3-[11-(3,5-diphenylphenyl)indolo[3,2-b]carbazol-5-yl]phenyl]-1,3-benzothiazole;2-[4-[11-(3,5-diphenylphenyl)indolo[3,2-b]carbazol-5-yl]phenyl]-1,3-benzothiazole;2-[2-[5-(3-phenylphenyl)indolo[3,2-b]carbazol-11-yl]phenyl]-1,3-benzothiazole;2-[3-[5-(3-phenylphenyl)indolo[3,2-b]carbazol-11-yl]phenyl]-1,3-benzothiazole
CID 160697130
2-[7-[7-[10-(1,3-benzothiazol-2-yl)benzo[c]carbazol-7-yl]-9,9-dimethylfluoren-2-yl]benzo[c]carbazol-10-yl]-1,3-benzothiazole;2-[9-[7-[3-(1,3-benzothiazol-2-yl)carbazol-9-yl]-9,9-dimethylfluoren-2-yl]carbazol-3-yl]-1,3-benzothiazole;2-[9-[7-[3-(1,3-benzothiazol-2-yl)-6-phenylcarbazol-9-yl]-9,9-dimethylfluoren-2-yl]-6-phenylcarbazol-3-yl]-1,3-benzothiazole
CID 158903280
3-[9-(4-naphthalen-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(6-naphthalen-1-ylnaphthalen-2-yl)carbazol-3-yl]-9-phenylcarbazole
CID 159264413
2-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;2-[9-[4-(3,5-diphenylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;2-[9-[4-(3,5-diphenylphenyl)phenyl]carbazol-3-yl]-9-(4-phenylnaphthalen-1-yl)carbazole
CID 160531037
6-[4-(7-phenylindolo[2,3-b]carbazol-5-yl)phenyl]-2-(4-phenylphenyl)-1,3-benzothiazole
CID 145306641
3-[9-(3,5-diphenylphenyl)carbazol-2-yl]-9-[4-(3,5-diphenylphenyl)phenyl]carbazole;2-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-(4-phenylnaphthalen-1-yl)carbazole;2-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;2-[9-[4-(3,5-diphenylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;2-[9-[4-(3,5-diphenylphenyl)phenyl]carbazol-3-yl]-9-(4-phenylnaphthalen-1-yl)carbazole;2-[9-[4-(3,5-diphenylphenyl)phenyl]carbazol-3-yl]-9-(4-phenylphenyl)carbazole;9-[4-(3,5-diphenylphenyl)phenyl]-3-phenyl-6-[9-(4-phenylphenyl)carbazol-2-yl]carbazole
CID 157278148
2-(4-spiro[fluorene-9,11'-indeno[1,2-b]carbazole]-5'-ylnaphthalen-1-yl)-1,3-benzothiazole;2-(2-spiro[fluorene-9,11'-indeno[1,2-b]carbazole]-5'-ylphenyl)-1,3-benzothiazole;2-(3-spiro[fluorene-9,11'-indeno[1,2-b]carbazole]-5'-ylphenyl)-1,3-benzothiazole;2-(4-spiro[fluorene-9,11'-indeno[1,2-b]carbazole]-5'-ylphenyl)-1,3-benzothiazole
CID 159324091
2-[4-carbazol-9-yl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]-1,3-benzothiazole
CID 171756549
3-(9-naphthalen-1-ylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole;9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 159733846
7-N-[4-(1,3-benzothiazol-2-yl)phenyl]-2-N-(9-phenylcarbazol-3-yl)-2-N,7-N-bis(4-phenylphenyl)phenanthrene-2,7-diamine
CID 170267406

Frequently Asked Questions

What is the IUPAC name of 2-[2-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[2-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole?
The IUPAC name of 2-[2-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[2-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole (CID 159144378) is 2-[2-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[2-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole.
What is the SMILES notation for 2-[2-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[2-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole?
The canonical SMILES for 2-[2-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[2-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole is c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cc(-c6nc7ccccc7s6)c6ccccc6c5)ccc43)cc2)cc1.c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccc(-c6nc7ccccc7s6)c6ccccc56)ccc43)cc2)cc1.c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccc6ccccc6c5-c5nc6ccccc6s5)ccc43)cc2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5ccccc5c4-c4nc5ccccc5s4)ccc32)cc1.
What is the InChIKey of 2-[2-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[2-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole?
The InChIKey is KIMMYPBUAYCCFT-UHFFFAOYSA-N. The full InChI is InChI=1S/3C53H33N3S.C47H29N3S/c1-2-12-34(13-3-1)35-22-27-39(28-23-35)55-46-19-9-6-16-41(46)43-32-37(25-29-48(43)55)38-26-30-49-44(33-38)42-17-7-10-20-47(42)56(49)50-31-24-36-14-4-5-15-40(36)52(50)53-54-45-18-8-11-21-51(45)57-53;1-2-12-34(13-3-1)35-22-26-38(27-23-35)55-47-19-9-6-16-41(47)44-32-36(24-29-50(44)55)37-25-30-51-45(33-37)42-17-7-10-20-48(42)56(51)49-31-28-43(39-14-4-5-15-40(39)49)53-54-46-18-8-11-21-52(46)57-53;1-2-12-34(13-3-1)35-22-26-39(27-23-35)55-48-19-9-6-16-42(48)44-31-36(24-28-50(44)55)37-25-29-51-45(32-37)43-17-7-10-20-49(43)56(51)40-30-38-14-4-5-15-41(38)46(33-40)53-54-47-18-8-11-21-52(47)57-53;1-2-13-33(14-3-1)49-40-19-9-6-16-35(40)37-28-31(23-25-42(37)49)32-24-26-43-38(29-32)36-17-7-10-20-41(36)50(43)44-27-22-30-12-4-5-15-34(30)46(44)47-48-39-18-8-11-21-45(39)51-47/h3*1-33H;1-29H.
What are the key properties of 2-[2-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[2-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole?
2-[2-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[2-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole has a molecular weight of 2899.64 g/mol, XLogP of 56.91, 19 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[2-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole;2-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]naphthalen-1-yl]-1,3-benzothiazole is sourced from PubChem (CID 159144378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).