3-(10-benzo[a]anthracen-4-ylanthracen-9-yl)naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(2-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole

C312H190S7 — CID 159620290

IUPAC3-(10-benzo[a]anthracen-4-ylanthracen-9-yl)naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(2-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole
SMILESc1cc(-c2ccc3ccccc3c2)cc(-c2c3ccccc3c(-c3ccc4c(c3)sc3cc5ccccc5cc34)c3ccccc23)c1.c1cc(-c2cccc3ccccc23)cc(-c2c3ccccc3c(-c3ccc4c(c3)sc3cc5ccccc5cc34)c3ccccc23)c1.c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc5c(c4)sc4cc6ccccc6cc45)c4ccccc34)cc2)cc1.c1ccc(-c2cccc(-c3c4ccccc4c(-c4ccc5c(c4)sc4cc6ccccc6cc45)c4ccccc34)c2)cc1.c1ccc(-c2ccccc2-c2c3ccccc3c(-c3ccc4c(c3)sc3cc5ccccc5cc34)c3ccccc23)cc1.c1ccc2cc3c(cc2c1)sc1cc(-c2c4ccccc4c(-c4ccc(-c5cccc6ccccc56)cc4)c4ccccc24)ccc13.c1ccc2cc3c(ccc4c(-c5c6ccccc6c(-c6ccc7c(c6)sc6cc8ccccc8cc67)c6ccccc56)cccc43)cc2c1
InChIInChI=1S/C48H28S.3C46H28S.3C42H26S/c1-2-11-30-25-43-33(24-29(30)10-1)20-22-36-35(43)18-9-19-38(36)48-41-16-7-5-14-39(41)47(40-15-6-8-17-42(40)48)34-21-23-37-44-26-31-12-3-4-13-32(31)27-46(44)49-45(37)28-34;1-2-13-31-27-44-42(26-30(31)12-1)37-24-23-34(28-43(37)47-44)46-40-20-7-5-18-38(40)45(39-19-6-8-21-41(39)46)33-16-9-15-32(25-33)36-22-10-14-29-11-3-4-17-35(29)36;1-2-12-33-27-44-42(26-32(33)11-1)37-25-24-34(28-43(37)47-44)46-40-17-7-5-15-38(40)45(39-16-6-8-18-41(39)46)31-22-20-30(21-23-31)36-19-9-13-29-10-3-4-14-35(29)36;1-2-11-30-24-34(21-20-29(30)10-1)31-14-9-15-35(25-31)45-38-16-5-7-18-40(38)46(41-19-8-6-17-39(41)45)36-22-23-37-42-26-32-12-3-4-13-33(32)27-44(42)47-43(37)28-36;1-2-11-27(12-3-1)28-15-10-16-31(23-28)41-34-17-6-8-19-36(34)42(37-20-9-7-18-35(37)41)32-21-22-33-38-24-29-13-4-5-14-30(29)25-40(38)43-39(33)26-32;1-2-10-27(11-3-1)28-18-20-29(21-19-28)41-34-14-6-8-16-36(34)42(37-17-9-7-15-35(37)41)32-22-23-33-38-24-30-12-4-5-13-31(30)25-40(38)43-39(33)26-32;1-2-12-27(13-3-1)31-16-6-7-17-33(31)42-36-20-10-8-18-34(36)41(35-19-9-11-21-37(35)42)30-22-23-32-38-24-28-14-4-5-15-29(28)25-40(38)43-39(32)26-30/h1-28H;3*1-28H;3*1-26H
InChIKeyMNUSLOWJNGBZHK-UHFFFAOYSA-N
MW4163.42 g/mol
LogP92.86
Rot. Bonds20

About 3-(10-benzo[a]anthracen-4-ylanthracen-9-yl)naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(2-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole

3-(10-benzo[a]anthracen-4-ylanthracen-9-yl)naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(2-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole (PubChem CID 159620290) has the molecular formula C312H190S7 and a molecular weight of 4163.42 g/mol. Its IUPAC name is 3-(10-benzo[a]anthracen-4-ylanthracen-9-yl)naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(2-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole.

Molecular Properties

Compound Name3-(10-benzo[a]anthracen-4-ylanthracen-9-yl)naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(2-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole
PubChem CID159620290
Molecular FormulaC312H190S7
Molecular Weight4163.42 g/mol
Exact Mass4159.29
IUPAC Name3-(10-benzo[a]anthracen-4-ylanthracen-9-yl)naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(2-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole
SMILESc1cc(-c2ccc3ccccc3c2)cc(-c2c3ccccc3c(-c3ccc4c(c3)sc3cc5ccccc5cc34)c3ccccc23)c1.c1cc(-c2cccc3ccccc23)cc(-c2c3ccccc3c(-c3ccc4c(c3)sc3cc5ccccc5cc34)c3ccccc23)c1.c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc5c(c4)sc4cc6ccccc6cc45)c4ccccc34)cc2)cc1.c1ccc(-c2cccc(-c3c4ccccc4c(-c4ccc5c(c4)sc4cc6ccccc6cc45)c4ccccc34)c2)cc1.c1ccc(-c2ccccc2-c2c3ccccc3c(-c3ccc4c(c3)sc3cc5ccccc5cc34)c3ccccc23)cc1.c1ccc2cc3c(cc2c1)sc1cc(-c2c4ccccc4c(-c4ccc(-c5cccc6ccccc56)cc4)c4ccccc24)ccc13.c1ccc2cc3c(ccc4c(-c5c6ccccc6c(-c6ccc7c(c6)sc6cc8ccccc8cc67)c6ccccc56)cccc43)cc2c1
InChIInChI=1S/C48H28S.3C46H28S.3C42H26S/c1-2-11-30-25-43-33(24-29(30)10-1)20-22-36-35(43)18-9-19-38(36)48-41-16-7-5-14-39(41)47(40-15-6-8-17-42(40)48)34-21-23-37-44-26-31-12-3-4-13-32(31)27-46(44)49-45(37)28-34;1-2-13-31-27-44-42(26-30(31)12-1)37-24-23-34(28-43(37)47-44)46-40-20-7-5-18-38(40)45(39-19-6-8-21-41(39)46)33-16-9-15-32(25-33)36-22-10-14-29-11-3-4-17-35(29)36;1-2-12-33-27-44-42(26-32(33)11-1)37-25-24-34(28-43(37)47-44)46-40-17-7-5-15-38(40)45(39-16-6-8-18-41(39)46)31-22-20-30(21-23-31)36-19-9-13-29-10-3-4-14-35(29)36;1-2-11-30-24-34(21-20-29(30)10-1)31-14-9-15-35(25-31)45-38-16-5-7-18-40(38)46(41-19-8-6-17-39(41)45)36-22-23-37-42-26-32-12-3-4-13-33(32)27-44(42)47-43(37)28-36;1-2-11-27(12-3-1)28-15-10-16-31(23-28)41-34-17-6-8-19-36(34)42(37-20-9-7-18-35(37)41)32-21-22-33-38-24-29-13-4-5-14-30(29)25-40(38)43-39(33)26-32;1-2-10-27(11-3-1)28-18-20-29(21-19-28)41-34-14-6-8-16-36(34)42(37-17-9-7-15-35(37)41)32-22-23-33-38-24-30-12-4-5-13-31(30)25-40(38)43-39(33)26-32;1-2-12-27(13-3-1)31-16-6-7-17-33(31)42-36-20-10-8-18-34(36)41(35-19-9-11-21-37(35)42)30-22-23-32-38-24-28-14-4-5-15-29(28)25-40(38)43-39(32)26-30/h1-28H;3*1-28H;3*1-26H
InChIKeyMNUSLOWJNGBZHK-UHFFFAOYSA-N
XLogP92.86
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds20
Heavy Atoms319
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5004163.42
LogP ≤ 592.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 3-(10-benzo[a]anthracen-4-ylanthracen-9-yl)naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(2-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole with MolForge

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Related Compounds

3-(10-naphthalen-1-ylanthracen-9-yl)dibenzothiophene;3-(10-naphthalen-2-ylanthracen-9-yl)dibenzothiophene;3-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]dibenzothiophene;3-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]dibenzothiophene;2-(10-phenanthren-9-ylanthracen-9-yl)dibenzothiophene;3-(10-phenylanthracen-9-yl)dibenzothiophene;3-[10-(2-phenylphenyl)anthracen-9-yl]dibenzothiophene
CID 158408767
3-(10-naphthalen-2-ylanthracen-9-yl)dibenzothiophene;3-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]dibenzothiophene;2-(10-phenanthren-9-ylanthracen-9-yl)dibenzothiophene;3-(10-phenylanthracen-9-yl)dibenzothiophene;2-[10-(3-phenylphenyl)anthracen-9-yl]dibenzothiophene;3-[10-(2-phenylphenyl)anthracen-9-yl]dibenzothiophene
CID 158994497
4-(9-naphthalen-2-yl-10-phenylanthracen-2-yl)benzo[a]anthracene;4-(10-naphthalen-2-yl-9-phenylanthracen-2-yl)benzo[a]anthracene;4-[9-naphthalen-1-yl-10-(3-phenylphenyl)anthracen-2-yl]benzo[a]anthracene;4-[10-naphthalen-1-yl-9-(3-phenylphenyl)anthracen-2-yl]benzo[a]anthracene
CID 162211913
9-naphthalen-1-yl-10-(3-phenanthren-2-ylphenyl)anthracene;9-naphthalen-1-yl-10-(4-phenanthren-3-ylphenyl)anthracene;9-naphthalen-2-yl-10-(3-phenanthren-2-ylphenyl)anthracene;9-naphthalen-2-yl-10-(4-phenanthren-3-ylphenyl)anthracene;9-(3-naphthalen-1-ylphenyl)-10-(3-phenanthren-2-ylphenyl)anthracene;9-(3-naphthalen-2-ylphenyl)-10-(3-phenanthren-2-ylphenyl)anthracene;9-(4-naphthalen-1-ylphenyl)-10-(3-phenanthren-2-ylphenyl)anthracene;9-(3-phenanthren-2-ylphenyl)-10-(2-phenylphenyl)anthracene
CID 158900728
9-[6-(3-naphthalen-2-ylphenyl)naphthalen-1-yl]-10-phenylanthracene;9-(2-naphthalen-2-ylphenyl)-10-phenylanthracene;9-(4-naphthalen-1-ylphenyl)-10-phenylanthracene;9-(4-naphthalen-2-ylphenyl)-10-phenylanthracene
CID 165002547
9-(2-naphthalen-1-ylphenyl)-10-phenylanthracene;9-(2-naphthalen-2-ylphenyl)-10-phenylanthracene;9-(3-naphthalen-1-ylphenyl)-10-phenylanthracene;9-(3-naphthalen-2-ylphenyl)-10-phenylanthracene;9-(4-naphthalen-1-ylphenyl)-10-phenylanthracene;9-(4-naphthalen-2-ylphenyl)-10-phenylanthracene;9-(4-phenanthren-1-ylphenyl)-10-phenylanthracene;9-phenyl-10-(2-phenylphenyl)anthracene;9-phenyl-10-(3-phenylphenyl)anthracene;9-phenyl-10-(4-phenylphenyl)anthracene
CID 165066854
4-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]benzo[a]anthracene;4-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]benzo[a]anthracene;4-[10-[3-(3-naphthalen-1-ylphenyl)phenyl]anthracen-9-yl]benzo[a]anthracene;4-[10-[3-(3-naphthalen-2-ylphenyl)phenyl]anthracen-9-yl]benzo[a]anthracene
CID 158321046
9,10-bis(2-phenylphenyl)anthracene;9-(3-naphthalen-1-ylphenyl)-10-phenylanthracene;9-(3-naphthalen-2-ylphenyl)-10-phenylanthracene;9-(4-naphthalen-1-ylphenyl)-10-phenylanthracene;9-(4-naphthalen-2-ylphenyl)-10-phenylanthracene;9-phenanthren-3-yl-10-phenylanthracene;9-(3-phenanthren-9-ylphenyl)-10-phenylanthracene;9-(4-phenanthren-9-ylphenyl)-10-phenylanthracene;9-(2-phenylphenyl)-10-(3-phenylphenyl)anthracene;9-(2-phenylphenyl)-10-(4-phenylphenyl)anthracene
CID 160536596
3-[10-(2-naphthalen-1-ylphenyl)anthracen-9-yl]dibenzothiophene;3-(10-phenylanthracen-9-yl)dibenzothiophene;3-[10-(2-phenylphenyl)anthracen-9-yl]dibenzothiophene;3-[10-(3-phenylphenyl)anthracen-9-yl]dibenzothiophene;3-[10-(4-phenylphenyl)anthracen-9-yl]dibenzothiophene
CID 158571909
9,10-bis(2-phenylphenyl)anthracene;9,10-bis(3-phenylphenyl)anthracene;9,10-bis(4-phenylphenyl)anthracene;9,10-bis[4-(4-phenylphenyl)phenyl]anthracene;9,10-dinaphthalen-1-ylanthracene;9,10-dinaphthalen-2-ylanthracene;9,10-di(phenanthren-9-yl)anthracene;9-naphthalen-1-yl-10-naphthalen-2-ylanthracene;9-naphthalen-1-yl-10-(4-naphthalen-1-ylphenyl)anthracene;9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)anthracene;9-naphthalen-1-yl-10-phenanthren-9-ylanthracene;9-(3-phenylphenyl)-10-(4-phenylphenyl)anthracene
CID 159698405
9-(2-naphthalen-1-ylphenyl)-10-phenylanthracene;9-(2-naphthalen-2-ylphenyl)-10-phenylanthracene;9-(3-naphthalen-1-ylphenyl)-10-phenylanthracene;9-(3-naphthalen-2-ylphenyl)-10-phenylanthracene;9-(4-naphthalen-1-ylphenyl)-10-phenylanthracene;9-(4-naphthalen-2-ylphenyl)-10-phenylanthracene
CID 165020657
bis(9-(3-naphthalen-1-ylphenyl)-10-[4-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]anthracene);9-(4-naphthalen-2-ylphenyl)-10-[4-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]anthracene;9-(2-phenylphenyl)-10-[4-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]anthracene;9-[2-(4-phenylphenyl)phenyl]-10-[4-[10-[2-(4-phenylphenyl)phenyl]anthracen-9-yl]phenyl]anthracene
CID 160597374

Frequently Asked Questions

What is the IUPAC name of 3-(10-benzo[a]anthracen-4-ylanthracen-9-yl)naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(2-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole?
The IUPAC name of 3-(10-benzo[a]anthracen-4-ylanthracen-9-yl)naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(2-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole (CID 159620290) is 3-(10-benzo[a]anthracen-4-ylanthracen-9-yl)naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(2-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole.
What is the SMILES notation for 3-(10-benzo[a]anthracen-4-ylanthracen-9-yl)naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(2-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole?
The canonical SMILES for 3-(10-benzo[a]anthracen-4-ylanthracen-9-yl)naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(2-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole is c1cc(-c2ccc3ccccc3c2)cc(-c2c3ccccc3c(-c3ccc4c(c3)sc3cc5ccccc5cc34)c3ccccc23)c1.c1cc(-c2cccc3ccccc23)cc(-c2c3ccccc3c(-c3ccc4c(c3)sc3cc5ccccc5cc34)c3ccccc23)c1.c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc5c(c4)sc4cc6ccccc6cc45)c4ccccc34)cc2)cc1.c1ccc(-c2cccc(-c3c4ccccc4c(-c4ccc5c(c4)sc4cc6ccccc6cc45)c4ccccc34)c2)cc1.c1ccc(-c2ccccc2-c2c3ccccc3c(-c3ccc4c(c3)sc3cc5ccccc5cc34)c3ccccc23)cc1.c1ccc2cc3c(cc2c1)sc1cc(-c2c4ccccc4c(-c4ccc(-c5cccc6ccccc56)cc4)c4ccccc24)ccc13.c1ccc2cc3c(ccc4c(-c5c6ccccc6c(-c6ccc7c(c6)sc6cc8ccccc8cc67)c6ccccc56)cccc43)cc2c1.
What is the InChIKey of 3-(10-benzo[a]anthracen-4-ylanthracen-9-yl)naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(2-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole?
The InChIKey is MNUSLOWJNGBZHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H28S.3C46H28S.3C42H26S/c1-2-11-30-25-43-33(24-29(30)10-1)20-22-36-35(43)18-9-19-38(36)48-41-16-7-5-14-39(41)47(40-15-6-8-17-42(40)48)34-21-23-37-44-26-31-12-3-4-13-32(31)27-46(44)49-45(37)28-34;1-2-13-31-27-44-42(26-30(31)12-1)37-24-23-34(28-43(37)47-44)46-40-20-7-5-18-38(40)45(39-19-6-8-21-41(39)46)33-16-9-15-32(25-33)36-22-10-14-29-11-3-4-17-35(29)36;1-2-12-33-27-44-42(26-32(33)11-1)37-25-24-34(28-43(37)47-44)46-40-17-7-5-15-38(40)45(39-16-6-8-18-41(39)46)31-22-20-30(21-23-31)36-19-9-13-29-10-3-4-14-35(29)36;1-2-11-30-24-34(21-20-29(30)10-1)31-14-9-15-35(25-31)45-38-16-5-7-18-40(38)46(41-19-8-6-17-39(41)45)36-22-23-37-42-26-32-12-3-4-13-33(32)27-44(42)47-43(37)28-36;1-2-11-27(12-3-1)28-15-10-16-31(23-28)41-34-17-6-8-19-36(34)42(37-20-9-7-18-35(37)41)32-21-22-33-38-24-29-13-4-5-14-30(29)25-40(38)43-39(33)26-32;1-2-10-27(11-3-1)28-18-20-29(21-19-28)41-34-14-6-8-16-36(34)42(37-17-9-7-15-35(37)41)32-22-23-33-38-24-30-12-4-5-13-31(30)25-40(38)43-39(33)26-32;1-2-12-27(13-3-1)31-16-6-7-17-33(31)42-36-20-10-8-18-34(36)41(35-19-9-11-21-37(35)42)30-22-23-32-38-24-28-14-4-5-15-29(28)25-40(38)43-39(32)26-30/h1-28H;3*1-28H;3*1-26H.
What are the key properties of 3-(10-benzo[a]anthracen-4-ylanthracen-9-yl)naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(2-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole?
3-(10-benzo[a]anthracen-4-ylanthracen-9-yl)naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(2-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole has a molecular weight of 4163.42 g/mol, XLogP of 92.86, 20 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(10-benzo[a]anthracen-4-ylanthracen-9-yl)naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(2-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(3-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole;3-[10-(4-phenylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzothiole is sourced from PubChem (CID 159620290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).