8-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-5-phenylpyrido[4,3-b]indole;8-[4-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]-5-phenylpyrido[4,3-b]indole;8-[3-(10-phenylanthracen-9-yl)phenyl]-5-(2-propan-2-ylphenyl)pyrido[3,2-b]indole;6-[3-(10-phenylanthracen-9-yl)-5-(trifluoromethyl)phenyl]-9-[4-(4-phenylphenyl)phenyl]pyrido[2,3-b]indole;5-phenyl-8-[3-(10-phenylanthracen-9-yl)phenyl]pyrido[4,3-b]indole;9-phenyl-10-[3-[9-(3-phenylphenyl)pyrido[2,3-b]indol-6-yl]phenyl]anthracene-2-carbonitrile

C295H192F3N13 — CID 159286122

IUPAC8-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-5-phenylpyrido[4,3-b]indole;8-[4-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]-5-phenylpyrido[4,3-b]indole;8-[3-(10-phenylanthracen-9-yl)phenyl]-5-(2-propan-2-ylphenyl)pyrido[3,2-b]indole;6-[3-(10-phenylanthracen-9-yl)-5-(trifluoromethyl)phenyl]-9-[4-(4-phenylphenyl)phenyl]pyrido[2,3-b]indole;5-phenyl-8-[3-(10-phenylanthracen-9-yl)phenyl]pyrido[4,3-b]indole;9-phenyl-10-[3-[9-(3-phenylphenyl)pyrido[2,3-b]indol-6-yl]phenyl]anthracene-2-carbonitrile
SMILESCC(C)c1ccccc1-n1c2ccc(-c3cccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)c3)cc2c2ncccc21.FC(F)(F)c1cc(-c2ccc3c(c2)c2cccnc2n3-c2ccc(-c3ccc(-c4ccccc4)cc3)cc2)cc(-c2c3ccccc3c(-c3ccccc3)c3ccccc23)c1.N#Cc1ccc2c(-c3cccc(-c4ccc5c(c4)c4cccnc4n5-c4cccc(-c5ccccc5)c4)c3)c3ccccc3c(-c3ccccc3)c2c1.c1ccc(-c2c3ccccc3c(-c3cccc(-c4ccc5c(c4)c4cnccc4n5-c4ccccc4)c3)c3ccccc23)cc1.c1ccc(-n2c3ccncc3c3cc(-c4ccc(-c5c6ccccc6c(-c6ccc(-c7ccc8ccccc8c7)cc6)c6ccccc56)cc4)ccc32)cc1.c1ccc(-n2c3ccncc3c3cc(-c4cccc(-c5c6ccccc6c(-c6ccc7ccccc7c6)c6ccccc56)c4)ccc32)cc1
InChIInChI=1S/C56H35F3N2.C53H34N2.C50H31N3.C47H30N2.C46H34N2.C43H28N2/c57-56(58,59)44-33-42(32-43(34-44)54-48-18-9-7-16-46(48)53(40-14-5-2-6-15-40)47-17-8-10-19-49(47)54)41-27-30-52-51(35-41)50-20-11-31-60-55(50)61(52)45-28-25-39(26-29-45)38-23-21-37(22-24-38)36-12-3-1-4-13-36;1-2-12-43(13-3-1)55-50-29-28-42(33-48(50)49-34-54-31-30-51(49)55)37-20-25-39(26-21-37)53-46-16-8-6-14-44(46)52(45-15-7-9-17-47(45)53)38-23-18-36(19-24-38)41-27-22-35-10-4-5-11-40(35)32-41;51-32-33-23-25-43-46(28-33)48(35-14-5-2-6-15-35)41-20-7-8-21-42(41)49(43)39-18-9-16-36(29-39)38-24-26-47-45(31-38)44-22-11-27-52-50(44)53(47)40-19-10-17-37(30-40)34-12-3-1-4-13-34;1-2-15-37(16-3-1)49-44-24-23-34(29-42(44)43-30-48-26-25-45(43)49)33-13-10-14-35(28-33)46-38-17-6-8-19-40(38)47(41-20-9-7-18-39(41)46)36-22-21-31-11-4-5-12-32(31)27-36;1-30(2)35-18-10-11-23-41(35)48-42-26-25-33(29-40(42)46-43(48)24-13-27-47-46)32-16-12-17-34(28-32)45-38-21-8-6-19-36(38)44(31-14-4-3-5-15-31)37-20-7-9-22-39(37)45;1-3-12-29(13-4-1)42-34-18-7-9-20-36(34)43(37-21-10-8-19-35(37)42)32-15-11-14-30(26-32)31-22-23-40-38(27-31)39-28-44-25-24-41(39)45(40)33-16-5-2-6-17-33/h1-35H;1-34H;1-31H;1-30H;3-30H,1-2H3;1-28H
InChIKeyKZNKLOCVNHXZKK-UHFFFAOYSA-N
MW3975.87 g/mol
LogP79.90
Rot. Bonds29

About 8-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-5-phenylpyrido[4,3-b]indole;8-[4-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]-5-phenylpyrido[4,3-b]indole;8-[3-(10-phenylanthracen-9-yl)phenyl]-5-(2-propan-2-ylphenyl)pyrido[3,2-b]indole;6-[3-(10-phenylanthracen-9-yl)-5-(trifluoromethyl)phenyl]-9-[4-(4-phenylphenyl)phenyl]pyrido[2,3-b]indole;5-phenyl-8-[3-(10-phenylanthracen-9-yl)phenyl]pyrido[4,3-b]indole;9-phenyl-10-[3-[9-(3-phenylphenyl)pyrido[2,3-b]indol-6-yl]phenyl]anthracene-2-carbonitrile

8-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-5-phenylpyrido[4,3-b]indole;8-[4-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]-5-phenylpyrido[4,3-b]indole;8-[3-(10-phenylanthracen-9-yl)phenyl]-5-(2-propan-2-ylphenyl)pyrido[3,2-b]indole;6-[3-(10-phenylanthracen-9-yl)-5-(trifluoromethyl)phenyl]-9-[4-(4-phenylphenyl)phenyl]pyrido[2,3-b]indole;5-phenyl-8-[3-(10-phenylanthracen-9-yl)phenyl]pyrido[4,3-b]indole;9-phenyl-10-[3-[9-(3-phenylphenyl)pyrido[2,3-b]indol-6-yl]phenyl]anthracene-2-carbonitrile (PubChem CID 159286122) has the molecular formula C295H192F3N13 and a molecular weight of 3975.87 g/mol. Its IUPAC name is 8-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-5-phenylpyrido[4,3-b]indole;8-[4-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]-5-phenylpyrido[4,3-b]indole;8-[3-(10-phenylanthracen-9-yl)phenyl]-5-(2-propan-2-ylphenyl)pyrido[3,2-b]indole;6-[3-(10-phenylanthracen-9-yl)-5-(trifluoromethyl)phenyl]-9-[4-(4-phenylphenyl)phenyl]pyrido[2,3-b]indole;5-phenyl-8-[3-(10-phenylanthracen-9-yl)phenyl]pyrido[4,3-b]indole;9-phenyl-10-[3-[9-(3-phenylphenyl)pyrido[2,3-b]indol-6-yl]phenyl]anthracene-2-carbonitrile.

Molecular Properties

Compound Name8-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-5-phenylpyrido[4,3-b]indole;8-[4-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]-5-phenylpyrido[4,3-b]indole;8-[3-(10-phenylanthracen-9-yl)phenyl]-5-(2-propan-2-ylphenyl)pyrido[3,2-b]indole;6-[3-(10-phenylanthracen-9-yl)-5-(trifluoromethyl)phenyl]-9-[4-(4-phenylphenyl)phenyl]pyrido[2,3-b]indole;5-phenyl-8-[3-(10-phenylanthracen-9-yl)phenyl]pyrido[4,3-b]indole;9-phenyl-10-[3-[9-(3-phenylphenyl)pyrido[2,3-b]indol-6-yl]phenyl]anthracene-2-carbonitrile
PubChem CID159286122
Molecular FormulaC295H192F3N13
Molecular Weight3975.87 g/mol
Exact Mass3972.54
IUPAC Name8-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-5-phenylpyrido[4,3-b]indole;8-[4-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]-5-phenylpyrido[4,3-b]indole;8-[3-(10-phenylanthracen-9-yl)phenyl]-5-(2-propan-2-ylphenyl)pyrido[3,2-b]indole;6-[3-(10-phenylanthracen-9-yl)-5-(trifluoromethyl)phenyl]-9-[4-(4-phenylphenyl)phenyl]pyrido[2,3-b]indole;5-phenyl-8-[3-(10-phenylanthracen-9-yl)phenyl]pyrido[4,3-b]indole;9-phenyl-10-[3-[9-(3-phenylphenyl)pyrido[2,3-b]indol-6-yl]phenyl]anthracene-2-carbonitrile
SMILESCC(C)c1ccccc1-n1c2ccc(-c3cccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)c3)cc2c2ncccc21.FC(F)(F)c1cc(-c2ccc3c(c2)c2cccnc2n3-c2ccc(-c3ccc(-c4ccccc4)cc3)cc2)cc(-c2c3ccccc3c(-c3ccccc3)c3ccccc23)c1.N#Cc1ccc2c(-c3cccc(-c4ccc5c(c4)c4cccnc4n5-c4cccc(-c5ccccc5)c4)c3)c3ccccc3c(-c3ccccc3)c2c1.c1ccc(-c2c3ccccc3c(-c3cccc(-c4ccc5c(c4)c4cnccc4n5-c4ccccc4)c3)c3ccccc23)cc1.c1ccc(-n2c3ccncc3c3cc(-c4ccc(-c5c6ccccc6c(-c6ccc(-c7ccc8ccccc8c7)cc6)c6ccccc56)cc4)ccc32)cc1.c1ccc(-n2c3ccncc3c3cc(-c4cccc(-c5c6ccccc6c(-c6ccc7ccccc7c6)c6ccccc56)c4)ccc32)cc1
InChIInChI=1S/C56H35F3N2.C53H34N2.C50H31N3.C47H30N2.C46H34N2.C43H28N2/c57-56(58,59)44-33-42(32-43(34-44)54-48-18-9-7-16-46(48)53(40-14-5-2-6-15-40)47-17-8-10-19-49(47)54)41-27-30-52-51(35-41)50-20-11-31-60-55(50)61(52)45-28-25-39(26-29-45)38-23-21-37(22-24-38)36-12-3-1-4-13-36;1-2-12-43(13-3-1)55-50-29-28-42(33-48(50)49-34-54-31-30-51(49)55)37-20-25-39(26-21-37)53-46-16-8-6-14-44(46)52(45-15-7-9-17-47(45)53)38-23-18-36(19-24-38)41-27-22-35-10-4-5-11-40(35)32-41;51-32-33-23-25-43-46(28-33)48(35-14-5-2-6-15-35)41-20-7-8-21-42(41)49(43)39-18-9-16-36(29-39)38-24-26-47-45(31-38)44-22-11-27-52-50(44)53(47)40-19-10-17-37(30-40)34-12-3-1-4-13-34;1-2-15-37(16-3-1)49-44-24-23-34(29-42(44)43-30-48-26-25-45(43)49)33-13-10-14-35(28-33)46-38-17-6-8-19-40(38)47(41-20-9-7-18-39(41)46)36-22-21-31-11-4-5-12-32(31)27-36;1-30(2)35-18-10-11-23-41(35)48-42-26-25-33(29-40(42)46-43(48)24-13-27-47-46)32-16-12-17-34(28-32)45-38-21-8-6-19-36(38)44(31-14-4-3-5-15-31)37-20-7-9-22-39(37)45;1-3-12-29(13-4-1)42-34-18-7-9-20-36(34)43(37-21-10-8-19-35(37)42)32-15-11-14-30(26-32)31-22-23-40-38(27-31)39-28-44-25-24-41(39)45(40)33-16-5-2-6-17-33/h1-35H;1-34H;1-31H;1-30H;3-30H,1-2H3;1-28H
InChIKeyKZNKLOCVNHXZKK-UHFFFAOYSA-N
XLogP79.90
TPSA130.71 Ų
H-Bond Donors
H-Bond Acceptors13
Rotatable Bonds29
Heavy Atoms311
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003975.87
LogP ≤ 579.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1013

Analyze 8-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-5-phenylpyrido[4,3-b]indole;8-[4-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]-5-phenylpyrido[4,3-b]indole;8-[3-(10-phenylanthracen-9-yl)phenyl]-5-(2-propan-2-ylphenyl)pyrido[3,2-b]indole;6-[3-(10-phenylanthracen-9-yl)-5-(trifluoromethyl)phenyl]-9-[4-(4-phenylphenyl)phenyl]pyrido[2,3-b]indole;5-phenyl-8-[3-(10-phenylanthracen-9-yl)phenyl]pyrido[4,3-b]indole;9-phenyl-10-[3-[9-(3-phenylphenyl)pyrido[2,3-b]indol-6-yl]phenyl]anthracene-2-carbonitrile with MolForge

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Related Compounds

9-[4-[6-[5-(10-naphthalen-2-ylanthracen-9-yl)-2-pyridinyl]-3-pyridinyl]phenyl]pyrido[2,3-b]indole;5-[4-[6-[5-(10-phenylanthracen-9-yl)-2-pyridinyl]-3-pyridinyl]phenyl]pyrido[3,2-b]indole;5-[4-[6-[5-(10-phenylanthracen-9-yl)-2-pyridinyl]-3-pyridinyl]phenyl]pyrido[4,3-b]indole;9-[3-[6-[5-(10-phenylanthracen-9-yl)-2-pyridinyl]-3-pyridinyl]phenyl]pyrido[2,3-b]indole;9-[4-[6-[5-(10-phenylanthracen-9-yl)-2-pyridinyl]-3-pyridinyl]phenyl]pyrido[3,4-b]indole
CID 158882618
5-[3-[10-(2,6-diphenylphenyl)anthracen-9-yl]-5-pyrido[4,3-b]indol-5-ylphenyl]pyrido[4,3-b]indole;8-(4-methylphenyl)-5-[3-(10-phenylanthracen-9-yl)-5-pyrido[2,3-b]indol-9-ylphenyl]pyrido[3,2-b]indole;5-[3-(10-naphthalen-2-ylanthracen-9-yl)-5-(8-phenylpyrido[4,3-b]indol-5-yl)phenyl]-8-phenylpyrido[4,3-b]indole;5-[3-(10-naphthalen-2-ylanthracen-9-yl)-5-pyrido[4,3-b]indol-5-ylphenyl]pyrido[4,3-b]indole;5-[3-(10-phenanthren-9-ylanthracen-9-yl)-5-(7-phenylpyrido[3,4-b]indol-9-yl)phenyl]-8-(trifluoromethyl)pyrido[4,3-b]indole;5-[3-(10-phenylanthracen-9-yl)-5-pyrido[4,3-b]indol-5-ylphenyl]pyrido[4,3-b]indole
CID 158657670
9-[4-[4-(3-methylphenyl)phenyl]phenyl]-6-[3-(10-phenylanthracen-9-yl)-5-(trifluoromethyl)phenyl]pyrido[2,3-b]indole
CID 130450011
8-[4-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]-5-(4-phenylphenyl)pyrido[4,3-b]indole
CID 121277490
6-[3-(9-dibenzofuran-3-ylcarbazol-3-yl)carbazol-9-yl]-9-phenylpyrido[2,3-b]indole;5-phenyl-8-[3-[3-[9-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]pyrido[3,2-b]indole;5-phenyl-8-[3-[9-(5-phenylpyrido[3,2-b]indol-8-yl)carbazol-3-yl]carbazol-9-yl]pyrido[3,2-b]indole;5-phenyl-8-[8-[5-(5-phenylpyrido[4,3-b]indol-8-yl)pyrido[4,3-b]indol-8-yl]pyrido[4,3-b]indol-5-yl]pyrido[4,3-b]indole
CID 158594485
5-phenyl-8-(9-phenylpyrido[2,3-b]indol-6-yl)pyrido[4,3-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[3,2-b]indole;5-phenyl-8-(9-phenylpyrido[3,4-b]indol-6-yl)pyrido[4,3-b]indole
CID 159102469
9-[3-[3-(20-phenyl-5,10,20-triazapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14,16,18-nonaen-10-yl)phenyl]phenyl]carbazole-3-carbonitrile
CID 139575294
8-phenyl-5-[4-(6-pyrido[4,3-b]indol-5-ylpyrido[2,3-b]indol-9-yl)phenyl]pyrido[4,3-b]indole
CID 170061041
9-[6-(10-naphthalen-1-ylanthracen-9-yl)naphthalen-2-yl]pyrido[3,4-b]indole;9-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]-7-propan-2-ylpyrido[3,4-b]indole;5-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]pyrido[4,3-b]indole;9-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]-5-(trifluoromethyl)pyrido[2,3-b]indole
CID 160617878
6-fluoro-5-[4-[4-(10-phenanthren-9-ylanthracen-9-yl)naphthalen-1-yl]phenyl]pyrido[3,2-b]indole;5-[4-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]phenyl]-8-phenylpyrido[4,3-b]indole;5-[3-[3-(10-phenylanthracen-9-yl)phenyl]phenyl]pyrido[4,3-b]indole;9-[4-[4-[10-(3-phenylphenyl)anthracen-9-yl]phenyl]naphthalen-1-yl]pyrido[3,4-b]indole
CID 157485761
ethane;4-[3-(10-naphthalen-2-yl-2-phenylanthracen-9-yl)carbazol-9-yl]benzonitrile
CID 143844229
8-[4-[6-naphthalen-2-yl-2-[3-(10-phenylanthracen-9-yl)phenyl]pyrimidin-4-yl]phenyl]-5-(4-phenylphenyl)pyrido[4,3-b]indole
CID 118968771

Frequently Asked Questions

What is the IUPAC name of 8-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-5-phenylpyrido[4,3-b]indole;8-[4-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]-5-phenylpyrido[4,3-b]indole;8-[3-(10-phenylanthracen-9-yl)phenyl]-5-(2-propan-2-ylphenyl)pyrido[3,2-b]indole;6-[3-(10-phenylanthracen-9-yl)-5-(trifluoromethyl)phenyl]-9-[4-(4-phenylphenyl)phenyl]pyrido[2,3-b]indole;5-phenyl-8-[3-(10-phenylanthracen-9-yl)phenyl]pyrido[4,3-b]indole;9-phenyl-10-[3-[9-(3-phenylphenyl)pyrido[2,3-b]indol-6-yl]phenyl]anthracene-2-carbonitrile?
The IUPAC name of 8-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-5-phenylpyrido[4,3-b]indole;8-[4-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]-5-phenylpyrido[4,3-b]indole;8-[3-(10-phenylanthracen-9-yl)phenyl]-5-(2-propan-2-ylphenyl)pyrido[3,2-b]indole;6-[3-(10-phenylanthracen-9-yl)-5-(trifluoromethyl)phenyl]-9-[4-(4-phenylphenyl)phenyl]pyrido[2,3-b]indole;5-phenyl-8-[3-(10-phenylanthracen-9-yl)phenyl]pyrido[4,3-b]indole;9-phenyl-10-[3-[9-(3-phenylphenyl)pyrido[2,3-b]indol-6-yl]phenyl]anthracene-2-carbonitrile (CID 159286122) is 8-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-5-phenylpyrido[4,3-b]indole;8-[4-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]-5-phenylpyrido[4,3-b]indole;8-[3-(10-phenylanthracen-9-yl)phenyl]-5-(2-propan-2-ylphenyl)pyrido[3,2-b]indole;6-[3-(10-phenylanthracen-9-yl)-5-(trifluoromethyl)phenyl]-9-[4-(4-phenylphenyl)phenyl]pyrido[2,3-b]indole;5-phenyl-8-[3-(10-phenylanthracen-9-yl)phenyl]pyrido[4,3-b]indole;9-phenyl-10-[3-[9-(3-phenylphenyl)pyrido[2,3-b]indol-6-yl]phenyl]anthracene-2-carbonitrile.
What is the SMILES notation for 8-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-5-phenylpyrido[4,3-b]indole;8-[4-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]-5-phenylpyrido[4,3-b]indole;8-[3-(10-phenylanthracen-9-yl)phenyl]-5-(2-propan-2-ylphenyl)pyrido[3,2-b]indole;6-[3-(10-phenylanthracen-9-yl)-5-(trifluoromethyl)phenyl]-9-[4-(4-phenylphenyl)phenyl]pyrido[2,3-b]indole;5-phenyl-8-[3-(10-phenylanthracen-9-yl)phenyl]pyrido[4,3-b]indole;9-phenyl-10-[3-[9-(3-phenylphenyl)pyrido[2,3-b]indol-6-yl]phenyl]anthracene-2-carbonitrile?
The canonical SMILES for 8-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-5-phenylpyrido[4,3-b]indole;8-[4-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]-5-phenylpyrido[4,3-b]indole;8-[3-(10-phenylanthracen-9-yl)phenyl]-5-(2-propan-2-ylphenyl)pyrido[3,2-b]indole;6-[3-(10-phenylanthracen-9-yl)-5-(trifluoromethyl)phenyl]-9-[4-(4-phenylphenyl)phenyl]pyrido[2,3-b]indole;5-phenyl-8-[3-(10-phenylanthracen-9-yl)phenyl]pyrido[4,3-b]indole;9-phenyl-10-[3-[9-(3-phenylphenyl)pyrido[2,3-b]indol-6-yl]phenyl]anthracene-2-carbonitrile is CC(C)c1ccccc1-n1c2ccc(-c3cccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)c3)cc2c2ncccc21.FC(F)(F)c1cc(-c2ccc3c(c2)c2cccnc2n3-c2ccc(-c3ccc(-c4ccccc4)cc3)cc2)cc(-c2c3ccccc3c(-c3ccccc3)c3ccccc23)c1.N#Cc1ccc2c(-c3cccc(-c4ccc5c(c4)c4cccnc4n5-c4cccc(-c5ccccc5)c4)c3)c3ccccc3c(-c3ccccc3)c2c1.c1ccc(-c2c3ccccc3c(-c3cccc(-c4ccc5c(c4)c4cnccc4n5-c4ccccc4)c3)c3ccccc23)cc1.c1ccc(-n2c3ccncc3c3cc(-c4ccc(-c5c6ccccc6c(-c6ccc(-c7ccc8ccccc8c7)cc6)c6ccccc56)cc4)ccc32)cc1.c1ccc(-n2c3ccncc3c3cc(-c4cccc(-c5c6ccccc6c(-c6ccc7ccccc7c6)c6ccccc56)c4)ccc32)cc1.
What is the InChIKey of 8-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-5-phenylpyrido[4,3-b]indole;8-[4-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]-5-phenylpyrido[4,3-b]indole;8-[3-(10-phenylanthracen-9-yl)phenyl]-5-(2-propan-2-ylphenyl)pyrido[3,2-b]indole;6-[3-(10-phenylanthracen-9-yl)-5-(trifluoromethyl)phenyl]-9-[4-(4-phenylphenyl)phenyl]pyrido[2,3-b]indole;5-phenyl-8-[3-(10-phenylanthracen-9-yl)phenyl]pyrido[4,3-b]indole;9-phenyl-10-[3-[9-(3-phenylphenyl)pyrido[2,3-b]indol-6-yl]phenyl]anthracene-2-carbonitrile?
The InChIKey is KZNKLOCVNHXZKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H35F3N2.C53H34N2.C50H31N3.C47H30N2.C46H34N2.C43H28N2/c57-56(58,59)44-33-42(32-43(34-44)54-48-18-9-7-16-46(48)53(40-14-5-2-6-15-40)47-17-8-10-19-49(47)54)41-27-30-52-51(35-41)50-20-11-31-60-55(50)61(52)45-28-25-39(26-29-45)38-23-21-37(22-24-38)36-12-3-1-4-13-36;1-2-12-43(13-3-1)55-50-29-28-42(33-48(50)49-34-54-31-30-51(49)55)37-20-25-39(26-21-37)53-46-16-8-6-14-44(46)52(45-15-7-9-17-47(45)53)38-23-18-36(19-24-38)41-27-22-35-10-4-5-11-40(35)32-41;51-32-33-23-25-43-46(28-33)48(35-14-5-2-6-15-35)41-20-7-8-21-42(41)49(43)39-18-9-16-36(29-39)38-24-26-47-45(31-38)44-22-11-27-52-50(44)53(47)40-19-10-17-37(30-40)34-12-3-1-4-13-34;1-2-15-37(16-3-1)49-44-24-23-34(29-42(44)43-30-48-26-25-45(43)49)33-13-10-14-35(28-33)46-38-17-6-8-19-40(38)47(41-20-9-7-18-39(41)46)36-22-21-31-11-4-5-12-32(31)27-36;1-30(2)35-18-10-11-23-41(35)48-42-26-25-33(29-40(42)46-43(48)24-13-27-47-46)32-16-12-17-34(28-32)45-38-21-8-6-19-36(38)44(31-14-4-3-5-15-31)37-20-7-9-22-39(37)45;1-3-12-29(13-4-1)42-34-18-7-9-20-36(34)43(37-21-10-8-19-35(37)42)32-15-11-14-30(26-32)31-22-23-40-38(27-31)39-28-44-25-24-41(39)45(40)33-16-5-2-6-17-33/h1-35H;1-34H;1-31H;1-30H;3-30H,1-2H3;1-28H.
What are the key properties of 8-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-5-phenylpyrido[4,3-b]indole;8-[4-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]-5-phenylpyrido[4,3-b]indole;8-[3-(10-phenylanthracen-9-yl)phenyl]-5-(2-propan-2-ylphenyl)pyrido[3,2-b]indole;6-[3-(10-phenylanthracen-9-yl)-5-(trifluoromethyl)phenyl]-9-[4-(4-phenylphenyl)phenyl]pyrido[2,3-b]indole;5-phenyl-8-[3-(10-phenylanthracen-9-yl)phenyl]pyrido[4,3-b]indole;9-phenyl-10-[3-[9-(3-phenylphenyl)pyrido[2,3-b]indol-6-yl]phenyl]anthracene-2-carbonitrile?
8-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-5-phenylpyrido[4,3-b]indole;8-[4-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]-5-phenylpyrido[4,3-b]indole;8-[3-(10-phenylanthracen-9-yl)phenyl]-5-(2-propan-2-ylphenyl)pyrido[3,2-b]indole;6-[3-(10-phenylanthracen-9-yl)-5-(trifluoromethyl)phenyl]-9-[4-(4-phenylphenyl)phenyl]pyrido[2,3-b]indole;5-phenyl-8-[3-(10-phenylanthracen-9-yl)phenyl]pyrido[4,3-b]indole;9-phenyl-10-[3-[9-(3-phenylphenyl)pyrido[2,3-b]indol-6-yl]phenyl]anthracene-2-carbonitrile has a molecular weight of 3975.87 g/mol, XLogP of 79.90, 29 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-5-phenylpyrido[4,3-b]indole;8-[4-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]-5-phenylpyrido[4,3-b]indole;8-[3-(10-phenylanthracen-9-yl)phenyl]-5-(2-propan-2-ylphenyl)pyrido[3,2-b]indole;6-[3-(10-phenylanthracen-9-yl)-5-(trifluoromethyl)phenyl]-9-[4-(4-phenylphenyl)phenyl]pyrido[2,3-b]indole;5-phenyl-8-[3-(10-phenylanthracen-9-yl)phenyl]pyrido[4,3-b]indole;9-phenyl-10-[3-[9-(3-phenylphenyl)pyrido[2,3-b]indol-6-yl]phenyl]anthracene-2-carbonitrile is sourced from PubChem (CID 159286122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).