7-(1,3-benzothiazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzothiazol-6-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-5-yl)-[1]benzofuro[2,3-b]carbazole;bis(7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzofuro[2,3-b]carbazole);7-isoquinolin-6-yl-[1]benzofuro[2,3-b]carbazole;7-(1,3,5-triazin-2-yl)-[1]benzofuro[2,3-b]carbazole

C226H132N22O10S2 — CID 157323095

IUPAC7-(1,3-benzothiazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzothiazol-6-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-5-yl)-[1]benzofuro[2,3-b]carbazole;bis(7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzofuro[2,3-b]carbazole);7-isoquinolin-6-yl-[1]benzofuro[2,3-b]carbazole;7-(1,3,5-triazin-2-yl)-[1]benzofuro[2,3-b]carbazole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5cc6c(cc54)oc4ccccc46)cc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5cc6c(cc54)oc4ccccc46)cc3)n2)cc1.c1ccc2c(c1)oc1cc3c(cc12)c1ccccc1n3-c1ccc2cnccc2c1.c1ccc2c(c1)oc1cc3c(cc12)c1ccccc1n3-c1ccc2ncsc2c1.c1ccc2c(c1)oc1cc3c(cc12)c1ccccc1n3-c1ccc2ocnc2c1.c1ccc2c(c1)oc1cc3c(cc12)c1ccccc1n3-c1ncncn1.c1ccc2oc(-n3c4ccccc4c4cc5c(cc43)oc3ccccc35)nc2c1.c1ccc2sc(-n3c4ccccc4c4cc5c(cc43)oc3ccccc35)nc2c1
InChIInChI=1S/2C39H24N4O.C27H16N2O.2C25H14N2O2.2C25H14N2OS.C21H12N4O/c2*1-3-11-25(12-4-1)37-40-38(26-13-5-2-6-14-26)42-39(41-37)27-19-21-28(22-20-27)43-33-17-9-7-15-29(33)31-23-32-30-16-8-10-18-35(30)44-36(32)24-34(31)43;1-3-7-24-20(5-1)22-14-23-21-6-2-4-8-26(21)30-27(23)15-25(22)29(24)19-10-9-18-16-28-12-11-17(18)13-19;1-4-10-20-15(7-1)17-13-18-16-8-2-5-11-22(16)28-24(18)14-21(17)27(20)25-26-19-9-3-6-12-23(19)29-25;1-3-7-21-16(5-1)18-12-19-17-6-2-4-8-23(17)29-25(19)13-22(18)27(21)15-9-10-24-20(11-15)26-14-28-24;1-4-10-20-15(7-1)17-13-18-16-8-2-5-11-22(16)28-23(18)14-21(17)27(20)25-26-19-9-3-6-12-24(19)29-25;1-3-7-21-16(5-1)18-12-19-17-6-2-4-8-23(17)28-24(19)13-22(18)27(21)15-9-10-20-25(11-15)29-14-26-20;1-3-7-17-13(5-1)15-9-16-14-6-2-4-8-19(14)26-20(16)10-18(15)25(17)21-23-11-22-12-24-21/h2*1-24H;1-16H;4*1-14H;1-12H
InChIKeyBEKBAVDRTOSAKE-UHFFFAOYSA-N
MW3379.82 g/mol
LogP60.07
Rot. Bonds14

About 7-(1,3-benzothiazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzothiazol-6-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-5-yl)-[1]benzofuro[2,3-b]carbazole;bis(7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzofuro[2,3-b]carbazole);7-isoquinolin-6-yl-[1]benzofuro[2,3-b]carbazole;7-(1,3,5-triazin-2-yl)-[1]benzofuro[2,3-b]carbazole

7-(1,3-benzothiazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzothiazol-6-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-5-yl)-[1]benzofuro[2,3-b]carbazole;bis(7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzofuro[2,3-b]carbazole);7-isoquinolin-6-yl-[1]benzofuro[2,3-b]carbazole;7-(1,3,5-triazin-2-yl)-[1]benzofuro[2,3-b]carbazole (PubChem CID 157323095) has the molecular formula C226H132N22O10S2 and a molecular weight of 3379.82 g/mol. Its IUPAC name is 7-(1,3-benzothiazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzothiazol-6-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-5-yl)-[1]benzofuro[2,3-b]carbazole;bis(7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzofuro[2,3-b]carbazole);7-isoquinolin-6-yl-[1]benzofuro[2,3-b]carbazole;7-(1,3,5-triazin-2-yl)-[1]benzofuro[2,3-b]carbazole.

Molecular Properties

Compound Name7-(1,3-benzothiazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzothiazol-6-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-5-yl)-[1]benzofuro[2,3-b]carbazole;bis(7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzofuro[2,3-b]carbazole);7-isoquinolin-6-yl-[1]benzofuro[2,3-b]carbazole;7-(1,3,5-triazin-2-yl)-[1]benzofuro[2,3-b]carbazole
PubChem CID157323095
Molecular FormulaC226H132N22O10S2
Molecular Weight3379.82 g/mol
Exact Mass3376.99
IUPAC Name7-(1,3-benzothiazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzothiazol-6-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-5-yl)-[1]benzofuro[2,3-b]carbazole;bis(7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzofuro[2,3-b]carbazole);7-isoquinolin-6-yl-[1]benzofuro[2,3-b]carbazole;7-(1,3,5-triazin-2-yl)-[1]benzofuro[2,3-b]carbazole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5cc6c(cc54)oc4ccccc46)cc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5cc6c(cc54)oc4ccccc46)cc3)n2)cc1.c1ccc2c(c1)oc1cc3c(cc12)c1ccccc1n3-c1ccc2cnccc2c1.c1ccc2c(c1)oc1cc3c(cc12)c1ccccc1n3-c1ccc2ncsc2c1.c1ccc2c(c1)oc1cc3c(cc12)c1ccccc1n3-c1ccc2ocnc2c1.c1ccc2c(c1)oc1cc3c(cc12)c1ccccc1n3-c1ncncn1.c1ccc2oc(-n3c4ccccc4c4cc5c(cc43)oc3ccccc35)nc2c1.c1ccc2sc(-n3c4ccccc4c4cc5c(cc43)oc3ccccc35)nc2c1
InChIInChI=1S/2C39H24N4O.C27H16N2O.2C25H14N2O2.2C25H14N2OS.C21H12N4O/c2*1-3-11-25(12-4-1)37-40-38(26-13-5-2-6-14-26)42-39(41-37)27-19-21-28(22-20-27)43-33-17-9-7-15-29(33)31-23-32-30-16-8-10-18-35(30)44-36(32)24-34(31)43;1-3-7-24-20(5-1)22-14-23-21-6-2-4-8-26(21)30-27(23)15-25(22)29(24)19-10-9-18-16-28-12-11-17(18)13-19;1-4-10-20-15(7-1)17-13-18-16-8-2-5-11-22(16)28-24(18)14-21(17)27(20)25-26-19-9-3-6-12-23(19)29-25;1-3-7-21-16(5-1)18-12-19-17-6-2-4-8-23(17)29-25(19)13-22(18)27(21)15-9-10-24-20(11-15)26-14-28-24;1-4-10-20-15(7-1)17-13-18-16-8-2-5-11-22(16)28-23(18)14-21(17)27(20)25-26-19-9-3-6-12-24(19)29-25;1-3-7-21-16(5-1)18-12-19-17-6-2-4-8-23(17)28-24(19)13-22(18)27(21)15-9-10-20-25(11-15)29-14-26-20;1-3-7-17-13(5-1)15-9-16-14-6-2-4-8-19(14)26-20(16)10-18(15)25(17)21-23-11-22-12-24-21/h2*1-24H;1-16H;4*1-14H;1-12H
InChIKeyBEKBAVDRTOSAKE-UHFFFAOYSA-N
XLogP60.07
TPSA351.30 Ų
H-Bond Donors
H-Bond Acceptors34
Rotatable Bonds14
Heavy Atoms260
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003379.82
LogP ≤ 560.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1034

Analyze 7-(1,3-benzothiazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzothiazol-6-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-5-yl)-[1]benzofuro[2,3-b]carbazole;bis(7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzofuro[2,3-b]carbazole);7-isoquinolin-6-yl-[1]benzofuro[2,3-b]carbazole;7-(1,3,5-triazin-2-yl)-[1]benzofuro[2,3-b]carbazole with MolForge

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Related Compounds

2,6-Bis([1]benzofuro[2,3-a]carbazol-12-yl)-4-[2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzofuro[3,2-a]carbazol-12-yl)-4-[2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-[2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis[2,7-di(pyrimidin-2-yl)carbazol-9-yl]-4-[2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis[3,6-di(pyrimidin-2-yl)carbazol-9-yl]-4-[2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis[2-(6-phenyl-2-pyridinyl)carbazol-9-yl]-4-[2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis(2-pyrimidin-2-ylcarbazol-9-yl)-4-[2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis(3-pyrimidin-2-ylcarbazol-9-yl)-4-[2-(trifluoromethyl)phenyl]benzonitrile
CID 157432745
(3aS)-3a-hydroxy-6,7-dimethyl-1-(2-methyl-1,3-benzoxazol-5-yl)-2,3-dihydropyrrolo[2,3-b]quinolin-4-one;(3aS)-3a-hydroxy-6,7-dimethyl-1-(3-methylisoquinolin-6-yl)-2,3,9,9a-tetrahydropyrrolo[2,3-b]quinolin-4-one;(3aS)-1-(1-benzofuran-6-yl)-3a-hydroxy-6-methyl-7-(trifluoromethyl)-2,3-dihydropyrrolo[2,3-b]quinolin-4-one;(3aS)-1-(1,3-benzothiazol-6-yl)-3a-hydroxy-6,7-dimethyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-one;(9S)-9-hydroxy-4-methyl-12-phenyl-2,4,5,12-tetrazatricyclo[7.3.0.03,7]dodeca-3(7),5-dien-8-one
CID 158963702
3-[3,5-Bis([1]benzofuro[2,3-a]carbazol-12-yl)-4-(trifluoromethyl)phenyl]benzonitrile;3-[3,5-bis([1]benzofuro[3,2-a]carbazol-12-yl)-4-(trifluoromethyl)phenyl]benzonitrile;3-[3,5-bis([1]benzothiolo[2,3-a]carbazol-12-yl)-4-(trifluoromethyl)phenyl]benzonitrile;3-[3,5-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-(trifluoromethyl)phenyl]benzonitrile;9-[5-(3-isocyanophenyl)-3-(2-pyrimidin-2-ylcarbazol-9-yl)-2-(trifluoromethyl)phenyl]-2-pyrimidin-2-ylcarbazole
CID 159453971
2,6-Bis([1]benzofuro[3,2-a]carbazol-12-yl)-4-(2-cyano-6-methylphenyl)benzonitrile;2,6-bis([1]benzofuro[2,3-a]carbazol-12-yl)-4-[2-isocyano-6-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-[2-isocyano-6-(trifluoromethyl)phenyl]benzonitrile;4-[2-isocyano-6-(trifluoromethyl)phenyl]-2,6-bis(2-pyrimidin-2-ylcarbazol-9-yl)benzonitrile
CID 159561087
3,5-Bis([1]benzofuro[2,3-a]carbazol-12-yl)-4-[2-isocyano-6-(trifluoromethyl)phenyl]benzonitrile;3,5-bis([1]benzofuro[3,2-a]carbazol-12-yl)-4-[2-isocyano-6-(trifluoromethyl)phenyl]benzonitrile;3,5-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-[2-isocyano-6-(trifluoromethyl)phenyl]benzonitrile;4-[2-isocyano-6-(trifluoromethyl)phenyl]-3,5-bis(3-pyrimidin-2-ylcarbazol-9-yl)benzonitrile;4-[2-isocyano-6-(trifluoromethyl)phenyl]-3-(2-pyridin-2-ylcarbazol-9-yl)-5-(2-pyrimidin-2-ylcarbazol-9-yl)benzonitrile
CID 160533362
12-[3-([1]Benzofuro[2,3-a]carbazol-12-yl)-2-isocyano-4-[2-isocyano-6-(trifluoromethyl)phenyl]phenyl]-[1]benzofuro[2,3-a]carbazole;2,6-bis([1]benzofuro[3,2-a]carbazol-12-yl)-3-[2-isocyano-6-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-3-[2-isocyano-6-(trifluoromethyl)phenyl]benzonitrile;9-[3-[2,7-di(pyrimidin-2-yl)carbazol-9-yl]-2-isocyano-4-[2-isocyano-6-(trifluoromethyl)phenyl]phenyl]-2,7-di(pyrimidin-2-yl)carbazole;9-[2-isocyano-4-[2-isocyano-6-(trifluoromethyl)phenyl]-3-(3-pyrimidin-2-ylcarbazol-9-yl)phenyl]-3-pyrimidin-2-ylcarbazole;3-[2-isocyano-6-(trifluoromethyl)phenyl]-2,6-bis(2-pyrimidin-2-ylcarbazol-9-yl)benzonitrile
CID 160542497
2,5-Bis([1]benzofuro[2,3-a]carbazol-12-yl)-4-[2-methyl-6-(trifluoromethyl)phenyl]benzonitrile;2,5-bis([1]benzofuro[3,2-a]carbazol-12-yl)-4-[2-methyl-6-(trifluoromethyl)phenyl]benzonitrile;2,5-bis([1]benzothiolo[2,3-a]carbazol-12-yl)-4-[2-methyl-6-(trifluoromethyl)phenyl]benzonitrile;2,5-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-[2-methyl-6-(trifluoromethyl)phenyl]benzonitrile;2-(5-methylindolo[3,2-c]carbazol-12-yl)-4-[2-methyl-6-(trifluoromethyl)phenyl]-5-(5-phenylindolo[3,2-c]carbazol-12-yl)benzonitrile;4-[2-methyl-6-(trifluoromethyl)phenyl]-2,5-bis(11-phenylindolo[2,3-a]carbazol-12-yl)benzonitrile;4-[2-methyl-6-(trifluoromethyl)phenyl]-2,5-bis(2-pyrimidin-2-ylcarbazol-9-yl)benzonitrile;4-[2-methyl-6-(trifluoromethyl)phenyl]-2,5-bis(3-pyrimidin-2-ylcarbazol-9-yl)benzonitrile
CID 160830901
(3aS)-3a-hydroxy-6,7-dimethyl-1-(2-methyl-1,3-benzoxazol-6-yl)-2,3-dihydropyrrolo[2,3-b]quinolin-4-one;(3aS)-3a-hydroxy-6,7-dimethyl-1-quinazolin-6-yl-2,3-dihydropyrrolo[2,3-b]quinolin-4-one;(3aS)-3a-hydroxy-1-quinolin-6-yl-6-(trifluoromethyl)-2,3-dihydropyrrolo[2,3-b]quinolin-4-one;(9S)-9-hydroxy-5-methyl-12-quinolin-6-yl-4-thia-2,12-diazatricyclo[7.3.0.03,7]dodeca-1,3(7),5-trien-8-one
CID 160916672
(3aS)-3a-hydroxy-6,7-dimethyl-1-quinolin-6-yl-2,3-dihydropyrrolo[2,3-b]quinolin-4-one;(3aS)-1-(1,3-benzothiazol-6-yl)-3a-hydroxy-6-(trifluoromethyl)-2,3-dihydropyrrolo[2,3-b]quinolin-4-one;(3aS)-6-fluoro-3a-hydroxy-7-methyl-1-(2-methyl-1,3-benzoxazol-5-yl)-2,3-dihydropyrrolo[2,3-b]quinolin-4-one;(3aS)-6-fluoro-3a-hydroxy-7-methyl-1-quinolin-6-yl-2,3-dihydropyrrolo[2,3-b]quinolin-4-one;(9S)-5-ethyl-9-hydroxy-12-quinolin-6-yl-4-thia-2,12-diazatricyclo[7.3.0.03,7]dodeca-1,3(7),5-trien-8-one
CID 160933359
2-[3-Anthracen-9-yl-5-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-anthracen-9-yl-6-[3-(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)phenyl]-2-pyridinyl]-1,3-benzoxazole;2-[3-[3-(4,5-diphenyl-1,2,4-triazol-3-yl)phenyl]-5-(1,10-phenanthrolin-5-yl)phenyl]-1,3-benzothiazole;2-[3-(1,10-phenanthrolin-5-yl)-5-[3-[4-phenyl-5-[4-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]phenyl]phenyl]-1,3-benzothiazole;2-[6-[3-(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)phenyl]-2-quinoxalin-5-ylpyrimidin-4-yl]-1,3-benzoxazole
CID 161951747
14-[15-(3-Thia-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaen-24-yl)-8-oxa-6,14-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2(7),3,5,9,11,13(17),14-octaen-10-yl]-24-(8-thia-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaen-15-yl)-3-oxa-24-azahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11(16),12,14,18,20,22-undecaene
CID 134602351
2-[4-(1-Benzofuran-2-yl)-5-indol-1-yl-1-(1,2-oxazol-3-yl)-7-pyridin-2-yl-6-pyrimidin-2-yl-1-(1,3-thiazol-2-yl)-1,3-benzothiazol-2-yl]-1,3-benzoxazole
CID 141445846

Frequently Asked Questions

What is the IUPAC name of 7-(1,3-benzothiazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzothiazol-6-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-5-yl)-[1]benzofuro[2,3-b]carbazole;bis(7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzofuro[2,3-b]carbazole);7-isoquinolin-6-yl-[1]benzofuro[2,3-b]carbazole;7-(1,3,5-triazin-2-yl)-[1]benzofuro[2,3-b]carbazole?
The IUPAC name of 7-(1,3-benzothiazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzothiazol-6-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-5-yl)-[1]benzofuro[2,3-b]carbazole;bis(7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzofuro[2,3-b]carbazole);7-isoquinolin-6-yl-[1]benzofuro[2,3-b]carbazole;7-(1,3,5-triazin-2-yl)-[1]benzofuro[2,3-b]carbazole (CID 157323095) is 7-(1,3-benzothiazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzothiazol-6-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-5-yl)-[1]benzofuro[2,3-b]carbazole;bis(7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzofuro[2,3-b]carbazole);7-isoquinolin-6-yl-[1]benzofuro[2,3-b]carbazole;7-(1,3,5-triazin-2-yl)-[1]benzofuro[2,3-b]carbazole.
What is the SMILES notation for 7-(1,3-benzothiazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzothiazol-6-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-5-yl)-[1]benzofuro[2,3-b]carbazole;bis(7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzofuro[2,3-b]carbazole);7-isoquinolin-6-yl-[1]benzofuro[2,3-b]carbazole;7-(1,3,5-triazin-2-yl)-[1]benzofuro[2,3-b]carbazole?
The canonical SMILES for 7-(1,3-benzothiazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzothiazol-6-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-5-yl)-[1]benzofuro[2,3-b]carbazole;bis(7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzofuro[2,3-b]carbazole);7-isoquinolin-6-yl-[1]benzofuro[2,3-b]carbazole;7-(1,3,5-triazin-2-yl)-[1]benzofuro[2,3-b]carbazole is c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5cc6c(cc54)oc4ccccc46)cc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5cc6c(cc54)oc4ccccc46)cc3)n2)cc1.c1ccc2c(c1)oc1cc3c(cc12)c1ccccc1n3-c1ccc2cnccc2c1.c1ccc2c(c1)oc1cc3c(cc12)c1ccccc1n3-c1ccc2ncsc2c1.c1ccc2c(c1)oc1cc3c(cc12)c1ccccc1n3-c1ccc2ocnc2c1.c1ccc2c(c1)oc1cc3c(cc12)c1ccccc1n3-c1ncncn1.c1ccc2oc(-n3c4ccccc4c4cc5c(cc43)oc3ccccc35)nc2c1.c1ccc2sc(-n3c4ccccc4c4cc5c(cc43)oc3ccccc35)nc2c1.
What is the InChIKey of 7-(1,3-benzothiazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzothiazol-6-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-5-yl)-[1]benzofuro[2,3-b]carbazole;bis(7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzofuro[2,3-b]carbazole);7-isoquinolin-6-yl-[1]benzofuro[2,3-b]carbazole;7-(1,3,5-triazin-2-yl)-[1]benzofuro[2,3-b]carbazole?
The InChIKey is BEKBAVDRTOSAKE-UHFFFAOYSA-N. The full InChI is InChI=1S/2C39H24N4O.C27H16N2O.2C25H14N2O2.2C25H14N2OS.C21H12N4O/c2*1-3-11-25(12-4-1)37-40-38(26-13-5-2-6-14-26)42-39(41-37)27-19-21-28(22-20-27)43-33-17-9-7-15-29(33)31-23-32-30-16-8-10-18-35(30)44-36(32)24-34(31)43;1-3-7-24-20(5-1)22-14-23-21-6-2-4-8-26(21)30-27(23)15-25(22)29(24)19-10-9-18-16-28-12-11-17(18)13-19;1-4-10-20-15(7-1)17-13-18-16-8-2-5-11-22(16)28-24(18)14-21(17)27(20)25-26-19-9-3-6-12-23(19)29-25;1-3-7-21-16(5-1)18-12-19-17-6-2-4-8-23(17)29-25(19)13-22(18)27(21)15-9-10-24-20(11-15)26-14-28-24;1-4-10-20-15(7-1)17-13-18-16-8-2-5-11-22(16)28-23(18)14-21(17)27(20)25-26-19-9-3-6-12-24(19)29-25;1-3-7-21-16(5-1)18-12-19-17-6-2-4-8-23(17)28-24(19)13-22(18)27(21)15-9-10-20-25(11-15)29-14-26-20;1-3-7-17-13(5-1)15-9-16-14-6-2-4-8-19(14)26-20(16)10-18(15)25(17)21-23-11-22-12-24-21/h2*1-24H;1-16H;4*1-14H;1-12H.
What are the key properties of 7-(1,3-benzothiazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzothiazol-6-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-5-yl)-[1]benzofuro[2,3-b]carbazole;bis(7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzofuro[2,3-b]carbazole);7-isoquinolin-6-yl-[1]benzofuro[2,3-b]carbazole;7-(1,3,5-triazin-2-yl)-[1]benzofuro[2,3-b]carbazole?
7-(1,3-benzothiazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzothiazol-6-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-5-yl)-[1]benzofuro[2,3-b]carbazole;bis(7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzofuro[2,3-b]carbazole);7-isoquinolin-6-yl-[1]benzofuro[2,3-b]carbazole;7-(1,3,5-triazin-2-yl)-[1]benzofuro[2,3-b]carbazole has a molecular weight of 3379.82 g/mol, XLogP of 60.07, 14 rotatable bonds, 0 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(1,3-benzothiazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzothiazol-6-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-2-yl)-[1]benzofuro[2,3-b]carbazole;7-(1,3-benzoxazol-5-yl)-[1]benzofuro[2,3-b]carbazole;bis(7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzofuro[2,3-b]carbazole);7-isoquinolin-6-yl-[1]benzofuro[2,3-b]carbazole;7-(1,3,5-triazin-2-yl)-[1]benzofuro[2,3-b]carbazole is sourced from PubChem (CID 157323095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).