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

C170H102N10S4 — CID 159048482

IUPAC2-[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
SMILESc1ccc(-n2c3ccccc3c3cc4c(cc32)c2ccccc2n4-c2ccc(-c3nc4ccccc4s3)cc2)cc1.c1ccc(-n2c3ccccc3c3cc4c(cc32)c2ccccc2n4-c2cccc(-c3nc4ccccc4s3)c2)cc1.c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2cc3c(cc21)c1ccccc1n3-c1cc(-c2nc3ccccc3s2)c2ccccc2c1.c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2cc3c(cc21)c1ccccc1n3-c1ccc2ccccc2c1-c1nc2ccccc2s1
InChIInChI=1S/2C48H28N2S.2C37H23N3S/c1-2-14-31-29(13-1)25-30(26-38(31)47-49-43-22-10-12-24-46(43)51-47)50-44-23-11-6-18-35(44)37-27-42-36(28-45(37)50)34-17-5-9-21-41(34)48(42)39-19-7-3-15-32(39)33-16-4-8-20-40(33)48;1-2-14-30-29(13-1)25-26-43(46(30)47-49-41-22-10-12-24-45(41)51-47)50-42-23-11-6-18-34(42)36-27-40-35(28-44(36)50)33-17-5-9-21-39(33)48(40)37-19-7-3-15-31(37)32-16-4-8-20-38(32)48;1-2-12-25(13-3-1)39-32-18-7-4-15-27(32)29-23-35-30(22-34(29)39)28-16-5-8-19-33(28)40(35)26-14-10-11-24(21-26)37-38-31-17-6-9-20-36(31)41-37;1-2-10-25(11-3-1)39-32-15-7-4-12-27(32)29-23-35-30(22-34(29)39)28-13-5-8-16-33(28)40(35)26-20-18-24(19-21-26)37-38-31-14-6-9-17-36(31)41-37/h2*1-28H;2*1-23H
InChIKeyJWYMPGQVDBAPIR-UHFFFAOYSA-N
MW2413.02 g/mol
LogP45.43
Rot. Bonds10

About 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

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 (PubChem CID 159048482) has the molecular formula C170H102N10S4 and a molecular weight of 2413.02 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name2-[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
PubChem CID159048482
Molecular FormulaC170H102N10S4
Molecular Weight2413.02 g/mol
Exact Mass2410.72
IUPAC Name2-[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
SMILESc1ccc(-n2c3ccccc3c3cc4c(cc32)c2ccccc2n4-c2ccc(-c3nc4ccccc4s3)cc2)cc1.c1ccc(-n2c3ccccc3c3cc4c(cc32)c2ccccc2n4-c2cccc(-c3nc4ccccc4s3)c2)cc1.c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2cc3c(cc21)c1ccccc1n3-c1cc(-c2nc3ccccc3s2)c2ccccc2c1.c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2cc3c(cc21)c1ccccc1n3-c1ccc2ccccc2c1-c1nc2ccccc2s1
InChIInChI=1S/2C48H28N2S.2C37H23N3S/c1-2-14-31-29(13-1)25-30(26-38(31)47-49-43-22-10-12-24-46(43)51-47)50-44-23-11-6-18-35(44)37-27-42-36(28-45(37)50)34-17-5-9-21-41(34)48(42)39-19-7-3-15-32(39)33-16-4-8-20-40(33)48;1-2-14-30-29(13-1)25-26-43(46(30)47-49-41-22-10-12-24-45(41)51-47)50-42-23-11-6-18-34(42)36-27-40-35(28-44(36)50)33-17-5-9-21-39(33)48(40)37-19-7-3-15-31(37)32-16-4-8-20-38(32)48;1-2-12-25(13-3-1)39-32-18-7-4-15-27(32)29-23-35-30(22-34(29)39)28-16-5-8-19-33(28)40(35)26-14-10-11-24(21-26)37-38-31-17-6-9-20-36(31)41-37;1-2-10-25(11-3-1)39-32-15-7-4-12-27(32)29-23-35-30(22-34(29)39)28-13-5-8-16-33(28)40(35)26-20-18-24(19-21-26)37-38-31-14-6-9-17-36(31)41-37/h2*1-28H;2*1-23H
InChIKeyJWYMPGQVDBAPIR-UHFFFAOYSA-N
XLogP45.43
TPSA81.14 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds10
Heavy Atoms184
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002413.02
LogP ≤ 545.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Analyze 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 with MolForge

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Related Compounds

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-[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
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
3-(7'-carbazol-9-yl-9,9'-spirobi[fluorene]-2'-yl)-9-naphthalen-1-ylcarbazole;3-(7'-carbazol-9-yl-9,9'-spirobi[fluorene]-2'-yl)-9-(4-phenylphenyl)carbazole
CID 158661132
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
9-phenyl-3-spiro[benzo[c]fluorene-7,9'-fluorene]-2'-ylcarbazole
CID 129264521
beryllium;bis(2-(1,3-benzothiazol-3-ium-2-yl)naphthalen-1-olate);bis(2-(1,3-benzothiazol-2-yl)phenol);12-(2,6-diphenyl-4-pyridinyl)-16-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-undecaene;2,4-diphenyl-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazine;zinc
CID 158569544
2-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-2-yl]-1,3-benzothiazole
CID 149057989
CID 157397756
CID 157397756
11,11-dimethyl-5-(9-phenylcarbazol-3-yl)indeno[1,2-b]carbazole;11,11-dimethyl-5-(4-phenylnaphthalen-1-yl)indeno[1,2-b]carbazole;bis(11,11-dimethyl-5-(5-phenylnaphthalen-2-yl)indeno[1,2-b]carbazole);11,11-dimethyl-5-(7-phenylnaphthalen-2-yl)indeno[1,2-b]carbazole;11,11-dimethyl-5-(3-phenylphenyl)indeno[1,2-b]carbazole;11,11-dimethyl-5-(4-phenylphenyl)indeno[1,2-b]carbazole
CID 157178540
2-[9-[3-[3-(4-phenylphenyl)-2-pyridinyl]phenyl]carbazol-2-yl]-1,3-benzothiazole
CID 153285461

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is c1ccc(-n2c3ccccc3c3cc4c(cc32)c2ccccc2n4-c2ccc(-c3nc4ccccc4s3)cc2)cc1.c1ccc(-n2c3ccccc3c3cc4c(cc32)c2ccccc2n4-c2cccc(-c3nc4ccccc4s3)c2)cc1.c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2cc3c(cc21)c1ccccc1n3-c1cc(-c2nc3ccccc3s2)c2ccccc2c1.c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2cc3c(cc21)c1ccccc1n3-c1ccc2ccccc2c1-c1nc2ccccc2s1.
What is the InChIKey of 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?
The InChIKey is JWYMPGQVDBAPIR-UHFFFAOYSA-N. The full InChI is InChI=1S/2C48H28N2S.2C37H23N3S/c1-2-14-31-29(13-1)25-30(26-38(31)47-49-43-22-10-12-24-46(43)51-47)50-44-23-11-6-18-35(44)37-27-42-36(28-45(37)50)34-17-5-9-21-41(34)48(42)39-19-7-3-15-32(39)33-16-4-8-20-40(33)48;1-2-14-30-29(13-1)25-26-43(46(30)47-49-41-22-10-12-24-45(41)51-47)50-42-23-11-6-18-34(42)36-27-40-35(28-44(36)50)33-17-5-9-21-39(33)48(40)37-19-7-3-15-31(37)32-16-4-8-20-38(32)48;1-2-12-25(13-3-1)39-32-18-7-4-15-27(32)29-23-35-30(22-34(29)39)28-16-5-8-19-33(28)40(35)26-14-10-11-24(21-26)37-38-31-17-6-9-20-36(31)41-37;1-2-10-25(11-3-1)39-32-15-7-4-12-27(32)29-23-35-30(22-34(29)39)28-13-5-8-16-33(28)40(35)26-20-18-24(19-21-26)37-38-31-14-6-9-17-36(31)41-37/h2*1-28H;2*1-23H.
What are the key properties of 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?
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 has a molecular weight of 2413.02 g/mol, XLogP of 45.43, 10 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 159048482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).