1-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;2-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;3-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;4-(12-naphthalen-1-ylchrysen-6-yl)dibenzothiophene;1-(12-phenylchrysen-6-yl)dibenzothiophene;2-(12-phenylchrysen-6-yl)dibenzothiophene;3-(12-phenylchrysen-6-yl)dibenzothiophene;4-(12-phenylchrysen-6-yl)dibenzothiophene

C304H184O3S5 — CID 161005842

IUPAC1-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;2-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;3-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;4-(12-naphthalen-1-ylchrysen-6-yl)dibenzothiophene;1-(12-phenylchrysen-6-yl)dibenzothiophene;2-(12-phenylchrysen-6-yl)dibenzothiophene;3-(12-phenylchrysen-6-yl)dibenzothiophene;4-(12-phenylchrysen-6-yl)dibenzothiophene
SMILESc1ccc(-c2cc3c4ccccc4c(-c4ccc5c(c4)sc4ccccc45)cc3c3ccccc23)cc1.c1ccc(-c2cc3c4ccccc4c(-c4ccc5sc6ccccc6c5c4)cc3c3ccccc23)cc1.c1ccc(-c2cc3c4ccccc4c(-c4cccc5c4sc4ccccc45)cc3c3ccccc23)cc1.c1ccc(-c2cc3c4ccccc4c(-c4cccc5sc6ccccc6c45)cc3c3ccccc23)cc1.c1ccc2c(-c3cc4c5ccccc5c(-c5cccc6c5sc5ccccc56)cc4c4ccccc34)cccc2c1.c1ccc2cc(-c3c4ccccc4c(-c4ccc5c(c4)oc4cc6ccccc6cc45)c4ccccc34)ccc2c1.c1ccc2cc(-c3c4ccccc4c(-c4ccc5oc6cc7ccccc7cc6c5c4)c4ccccc34)ccc2c1.c1ccc2cc(-c3c4ccccc4c(-c4cccc5oc6cc7ccccc7cc6c45)c4ccccc34)ccc2c1
InChIInChI=1S/3C40H24O.C40H24S.4C36H22S/c1-2-11-26-22-29(21-20-25(26)10-1)38-30-14-5-7-16-32(30)39(33-17-8-6-15-31(33)38)34-18-9-19-36-40(34)35-23-27-12-3-4-13-28(27)24-37(35)41-36;1-2-10-26-21-29(18-17-25(26)9-1)39-31-13-5-7-15-33(31)40(34-16-8-6-14-32(34)39)30-19-20-37-35(23-30)36-22-27-11-3-4-12-28(27)24-38(36)41-37;1-2-10-26-21-29(18-17-25(26)9-1)39-32-13-5-7-15-34(32)40(35-16-8-6-14-33(35)39)30-19-20-31-36-22-27-11-3-4-12-28(27)23-38(36)41-37(31)24-30;1-2-13-26-25(11-1)12-9-19-27(26)35-23-37-31-17-6-4-15-29(31)36(24-38(37)30-16-5-3-14-28(30)35)34-21-10-20-33-32-18-7-8-22-39(32)41-40(33)34;1-2-10-23(11-3-1)30-21-32-28-15-7-5-13-26(28)31(22-33(32)27-14-6-4-12-25(27)30)24-18-19-36-34(20-24)29-16-8-9-17-35(29)37-36;1-2-10-23(11-3-1)31-21-33-28-15-7-5-13-26(28)32(22-34(33)27-14-6-4-12-25(27)31)24-18-19-30-29-16-8-9-17-35(29)37-36(30)20-24;1-2-11-23(12-3-1)31-21-33-27-16-7-6-15-26(27)32(22-34(33)25-14-5-4-13-24(25)31)30-19-10-18-29-28-17-8-9-20-35(28)37-36(29)30;1-2-11-23(12-3-1)30-21-32-27-16-7-6-15-26(27)31(22-33(32)25-14-5-4-13-24(25)30)28-18-10-20-35-36(28)29-17-8-9-19-34(29)37-35/h4*1-24H;4*1-22H
InChIKeyTWMJBHPETABGDT-UHFFFAOYSA-N
MW4045.15 g/mol
LogP89.99
Rot. Bonds16

About 1-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;2-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;3-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;4-(12-naphthalen-1-ylchrysen-6-yl)dibenzothiophene;1-(12-phenylchrysen-6-yl)dibenzothiophene;2-(12-phenylchrysen-6-yl)dibenzothiophene;3-(12-phenylchrysen-6-yl)dibenzothiophene;4-(12-phenylchrysen-6-yl)dibenzothiophene

1-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;2-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;3-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;4-(12-naphthalen-1-ylchrysen-6-yl)dibenzothiophene;1-(12-phenylchrysen-6-yl)dibenzothiophene;2-(12-phenylchrysen-6-yl)dibenzothiophene;3-(12-phenylchrysen-6-yl)dibenzothiophene;4-(12-phenylchrysen-6-yl)dibenzothiophene (PubChem CID 161005842) has the molecular formula C304H184O3S5 and a molecular weight of 4045.15 g/mol. Its IUPAC name is 1-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;2-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;3-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;4-(12-naphthalen-1-ylchrysen-6-yl)dibenzothiophene;1-(12-phenylchrysen-6-yl)dibenzothiophene;2-(12-phenylchrysen-6-yl)dibenzothiophene;3-(12-phenylchrysen-6-yl)dibenzothiophene;4-(12-phenylchrysen-6-yl)dibenzothiophene.

Molecular Properties

Compound Name1-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;2-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;3-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;4-(12-naphthalen-1-ylchrysen-6-yl)dibenzothiophene;1-(12-phenylchrysen-6-yl)dibenzothiophene;2-(12-phenylchrysen-6-yl)dibenzothiophene;3-(12-phenylchrysen-6-yl)dibenzothiophene;4-(12-phenylchrysen-6-yl)dibenzothiophene
PubChem CID161005842
Molecular FormulaC304H184O3S5
Molecular Weight4045.15 g/mol
Exact Mass4041.28
IUPAC Name1-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;2-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;3-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;4-(12-naphthalen-1-ylchrysen-6-yl)dibenzothiophene;1-(12-phenylchrysen-6-yl)dibenzothiophene;2-(12-phenylchrysen-6-yl)dibenzothiophene;3-(12-phenylchrysen-6-yl)dibenzothiophene;4-(12-phenylchrysen-6-yl)dibenzothiophene
SMILESc1ccc(-c2cc3c4ccccc4c(-c4ccc5c(c4)sc4ccccc45)cc3c3ccccc23)cc1.c1ccc(-c2cc3c4ccccc4c(-c4ccc5sc6ccccc6c5c4)cc3c3ccccc23)cc1.c1ccc(-c2cc3c4ccccc4c(-c4cccc5c4sc4ccccc45)cc3c3ccccc23)cc1.c1ccc(-c2cc3c4ccccc4c(-c4cccc5sc6ccccc6c45)cc3c3ccccc23)cc1.c1ccc2c(-c3cc4c5ccccc5c(-c5cccc6c5sc5ccccc56)cc4c4ccccc34)cccc2c1.c1ccc2cc(-c3c4ccccc4c(-c4ccc5c(c4)oc4cc6ccccc6cc45)c4ccccc34)ccc2c1.c1ccc2cc(-c3c4ccccc4c(-c4ccc5oc6cc7ccccc7cc6c5c4)c4ccccc34)ccc2c1.c1ccc2cc(-c3c4ccccc4c(-c4cccc5oc6cc7ccccc7cc6c45)c4ccccc34)ccc2c1
InChIInChI=1S/3C40H24O.C40H24S.4C36H22S/c1-2-11-26-22-29(21-20-25(26)10-1)38-30-14-5-7-16-32(30)39(33-17-8-6-15-31(33)38)34-18-9-19-36-40(34)35-23-27-12-3-4-13-28(27)24-37(35)41-36;1-2-10-26-21-29(18-17-25(26)9-1)39-31-13-5-7-15-33(31)40(34-16-8-6-14-32(34)39)30-19-20-37-35(23-30)36-22-27-11-3-4-12-28(27)24-38(36)41-37;1-2-10-26-21-29(18-17-25(26)9-1)39-32-13-5-7-15-34(32)40(35-16-8-6-14-33(35)39)30-19-20-31-36-22-27-11-3-4-12-28(27)23-38(36)41-37(31)24-30;1-2-13-26-25(11-1)12-9-19-27(26)35-23-37-31-17-6-4-15-29(31)36(24-38(37)30-16-5-3-14-28(30)35)34-21-10-20-33-32-18-7-8-22-39(32)41-40(33)34;1-2-10-23(11-3-1)30-21-32-28-15-7-5-13-26(28)31(22-33(32)27-14-6-4-12-25(27)30)24-18-19-36-34(20-24)29-16-8-9-17-35(29)37-36;1-2-10-23(11-3-1)31-21-33-28-15-7-5-13-26(28)32(22-34(33)27-14-6-4-12-25(27)31)24-18-19-30-29-16-8-9-17-35(29)37-36(30)20-24;1-2-11-23(12-3-1)31-21-33-27-16-7-6-15-26(27)32(22-34(33)25-14-5-4-13-24(25)31)30-19-10-18-29-28-17-8-9-20-35(28)37-36(29)30;1-2-11-23(12-3-1)30-21-32-27-16-7-6-15-26(27)31(22-33(32)25-14-5-4-13-24(25)30)28-18-10-20-35-36(28)29-17-8-9-19-34(29)37-35/h4*1-24H;4*1-22H
InChIKeyTWMJBHPETABGDT-UHFFFAOYSA-N
XLogP89.99
TPSA39.42 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds16
Heavy Atoms312
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5004045.15
LogP ≤ 589.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 1-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;2-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;3-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;4-(12-naphthalen-1-ylchrysen-6-yl)dibenzothiophene;1-(12-phenylchrysen-6-yl)dibenzothiophene;2-(12-phenylchrysen-6-yl)dibenzothiophene;3-(12-phenylchrysen-6-yl)dibenzothiophene;4-(12-phenylchrysen-6-yl)dibenzothiophene with MolForge

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Related Compounds

1-(10-naphthalen-1-ylanthracen-9-yl)dibenzothiophene;2-(10-naphthalen-1-ylanthracen-9-yl)dibenzothiophene;3-(10-naphthalen-1-ylanthracen-9-yl)dibenzothiophene;4-(10-naphthalen-1-ylanthracen-9-yl)dibenzothiophene;4-(10-naphthalen-2-ylanthracen-9-yl)dibenzothiophene;1-[10-(4-phenylphenyl)anthracen-9-yl]dibenzothiophene;2-[10-(4-phenylphenyl)anthracen-9-yl]dibenzothiophene
CID 157305682
1-[4-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]dibenzothiophene;2-[4-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]dibenzothiophene;2-[4-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]dibenzothiophene;2-[4-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]dibenzofuran;2-[4-[10-(3-phenylphenyl)anthracen-9-yl]phenyl]dibenzofuran;2-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]dibenzofuran
CID 165019847
2-[10-(2-naphthalen-1-ylphenyl)anthracen-9-yl]dibenzofuran;2-[10-(2-naphthalen-2-ylphenyl)anthracen-9-yl]dibenzofuran;2-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]dibenzofuran;2-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]dibenzofuran;2-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]dibenzofuran;2-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]dibenzofuran;4-(10-phenylanthracen-9-yl)dibenzothiophene;2-[10-(2-phenylphenyl)anthracen-9-yl]dibenzofuran;2-[10-(3-phenylphenyl)anthracen-9-yl]dibenzofuran;2-[10-(4-phenylphenyl)anthracen-9-yl]dibenzofuran
CID 158521382
1-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]dibenzothiophene;1-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]dibenzothiophene;2-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]dibenzothiophene;2-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]dibenzothiophene;3-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]dibenzothiophene;3-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]dibenzothiophene;4-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]dibenzothiophene;4-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]dibenzothiophene
CID 165021765
2,6-bis(10-dibenzothiophen-1-ylanthracen-9-yl)dibenzofuran;2,6-bis(10-dibenzothiophen-2-ylanthracen-9-yl)dibenzofuran;2,6-bis(10-dibenzothiophen-3-ylanthracen-9-yl)dibenzofuran;2,6-bis(10-dibenzothiophen-4-ylanthracen-9-yl)dibenzofuran;8-[10-[6-(10-naphtho[1,2-b][1]benzofuran-8-ylanthracen-9-yl)dibenzofuran-2-yl]anthracen-9-yl]naphtho[1,2-b][1]benzofuran
CID 162050752
2-[2-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzothiophene;2-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzothiophene;2-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzothiophene;4-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzothiophene;4-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzothiophene;2-[6-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]naphthalen-2-yl]dibenzofuran;4-[6-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]naphthalen-2-yl]dibenzofuran;4-[3-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]dibenzothiophene;4-[4-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]dibenzothiophene;4-[4-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]dibenzothiophene
CID 158929637
2-dibenzothiophen-2-yl-4-phenyl-6-(8-triphenylen-2-yldibenzofuran-3-yl)-1,3,5-triazine;2-dibenzothiophen-2-yl-4-phenyl-6-(9-triphenylen-2-yldibenzofuran-3-yl)-1,3,5-triazine;2-dibenzothiophen-2-yl-4-phenyl-6-(6-triphenylen-2-yldibenzothiophen-3-yl)-1,3,5-triazine;2-dibenzothiophen-2-yl-4-phenyl-6-(8-triphenylen-2-yldibenzothiophen-3-yl)-1,3,5-triazine
CID 158245643
9-[10-(2-phenyl-[1]benzothiolo[4,5-b][1]benzothiol-6-yl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran
CID 174266074
6-[8-(10-naphthalen-2-ylanthracen-9-yl)dibenzothiophen-4-yl]-12,22-dioxahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2(11),3,5,7,9,14,16,18,20,23-undecaene;8-[7-(10-naphthalen-1-ylanthracen-9-yl)dibenzothiophen-2-yl]-12,16-dioxahexacyclo[11.11.0.02,11.04,9.015,23.017,22]tetracosa-1(13),2(11),3,5,7,9,14,17,19,21,23-undecaene;16-[8-(10-naphthalen-1-ylanthracen-9-yl)dibenzothiophen-4-yl]-3,14-dioxahexacyclo[11.11.0.02,10.04,9.015,24.017,22]tetracosa-1(13),2(10),4,6,8,11,15,17,19,21,23-undecaene;16-[8-(10-naphthalen-1-ylanthracen-9-yl)dibenzothiophen-4-yl]-9,14-dioxahexacyclo[11.11.0.02,10.03,8.015,24.017,22]tetracosa-1(13),2(10),3,5,7,11,15,17,19,21,23-undecaene;20-[7-(10-naphthalen-2-ylanthracen-9-yl)dibenzothiophen-2-yl]-9,24-dioxahexacyclo[11.11.0.02,10.03,8.014,23.016,21]tetracosa-1(13),2(10),3,5,7,11,14(23),15,17,19,21-undecaene
CID 162143012
1-[10-(7-phenylnaphthalen-1-yl)anthracen-9-yl]dibenzothiophene;2-[10-(7-phenylnaphthalen-1-yl)anthracen-9-yl]dibenzothiophene;3-[10-(7-phenylnaphthalen-1-yl)anthracen-9-yl]dibenzothiophene;4-[10-(7-phenylnaphthalen-1-yl)anthracen-9-yl]dibenzothiophene
CID 163477689
2-dibenzothiophen-1-yl-4-(8-dibenzothiophen-4-yldibenzofuran-3-yl)-6-phenyl-1,3,5-triazine;2-dibenzothiophen-2-yl-4-(8-dibenzothiophen-4-yldibenzofuran-3-yl)-6-phenyl-1,3,5-triazine;2-dibenzothiophen-3-yl-4-(8-dibenzothiophen-4-yldibenzofuran-3-yl)-6-phenyl-1,3,5-triazine
CID 157050517
2-(10-phenanthren-3-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;3-(10-phenylanthracen-9-yl)naphtho[2,3-b][1]benzothiole;9-(10-phenylanthracen-9-yl)naphtho[1,2-b][1]benzothiole;2-[3-(10-phenylanthracen-9-yl)phenyl]naphtho[2,3-b][1]benzothiole;8-[3-(10-phenylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzothiole
CID 158713118

Frequently Asked Questions

What is the IUPAC name of 1-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;2-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;3-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;4-(12-naphthalen-1-ylchrysen-6-yl)dibenzothiophene;1-(12-phenylchrysen-6-yl)dibenzothiophene;2-(12-phenylchrysen-6-yl)dibenzothiophene;3-(12-phenylchrysen-6-yl)dibenzothiophene;4-(12-phenylchrysen-6-yl)dibenzothiophene?
The IUPAC name of 1-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;2-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;3-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;4-(12-naphthalen-1-ylchrysen-6-yl)dibenzothiophene;1-(12-phenylchrysen-6-yl)dibenzothiophene;2-(12-phenylchrysen-6-yl)dibenzothiophene;3-(12-phenylchrysen-6-yl)dibenzothiophene;4-(12-phenylchrysen-6-yl)dibenzothiophene (CID 161005842) is 1-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;2-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;3-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;4-(12-naphthalen-1-ylchrysen-6-yl)dibenzothiophene;1-(12-phenylchrysen-6-yl)dibenzothiophene;2-(12-phenylchrysen-6-yl)dibenzothiophene;3-(12-phenylchrysen-6-yl)dibenzothiophene;4-(12-phenylchrysen-6-yl)dibenzothiophene.
What is the SMILES notation for 1-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;2-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;3-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;4-(12-naphthalen-1-ylchrysen-6-yl)dibenzothiophene;1-(12-phenylchrysen-6-yl)dibenzothiophene;2-(12-phenylchrysen-6-yl)dibenzothiophene;3-(12-phenylchrysen-6-yl)dibenzothiophene;4-(12-phenylchrysen-6-yl)dibenzothiophene?
The canonical SMILES for 1-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;2-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;3-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;4-(12-naphthalen-1-ylchrysen-6-yl)dibenzothiophene;1-(12-phenylchrysen-6-yl)dibenzothiophene;2-(12-phenylchrysen-6-yl)dibenzothiophene;3-(12-phenylchrysen-6-yl)dibenzothiophene;4-(12-phenylchrysen-6-yl)dibenzothiophene is c1ccc(-c2cc3c4ccccc4c(-c4ccc5c(c4)sc4ccccc45)cc3c3ccccc23)cc1.c1ccc(-c2cc3c4ccccc4c(-c4ccc5sc6ccccc6c5c4)cc3c3ccccc23)cc1.c1ccc(-c2cc3c4ccccc4c(-c4cccc5c4sc4ccccc45)cc3c3ccccc23)cc1.c1ccc(-c2cc3c4ccccc4c(-c4cccc5sc6ccccc6c45)cc3c3ccccc23)cc1.c1ccc2c(-c3cc4c5ccccc5c(-c5cccc6c5sc5ccccc56)cc4c4ccccc34)cccc2c1.c1ccc2cc(-c3c4ccccc4c(-c4ccc5c(c4)oc4cc6ccccc6cc45)c4ccccc34)ccc2c1.c1ccc2cc(-c3c4ccccc4c(-c4ccc5oc6cc7ccccc7cc6c5c4)c4ccccc34)ccc2c1.c1ccc2cc(-c3c4ccccc4c(-c4cccc5oc6cc7ccccc7cc6c45)c4ccccc34)ccc2c1.
What is the InChIKey of 1-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;2-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;3-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;4-(12-naphthalen-1-ylchrysen-6-yl)dibenzothiophene;1-(12-phenylchrysen-6-yl)dibenzothiophene;2-(12-phenylchrysen-6-yl)dibenzothiophene;3-(12-phenylchrysen-6-yl)dibenzothiophene;4-(12-phenylchrysen-6-yl)dibenzothiophene?
The InChIKey is TWMJBHPETABGDT-UHFFFAOYSA-N. The full InChI is InChI=1S/3C40H24O.C40H24S.4C36H22S/c1-2-11-26-22-29(21-20-25(26)10-1)38-30-14-5-7-16-32(30)39(33-17-8-6-15-31(33)38)34-18-9-19-36-40(34)35-23-27-12-3-4-13-28(27)24-37(35)41-36;1-2-10-26-21-29(18-17-25(26)9-1)39-31-13-5-7-15-33(31)40(34-16-8-6-14-32(34)39)30-19-20-37-35(23-30)36-22-27-11-3-4-12-28(27)24-38(36)41-37;1-2-10-26-21-29(18-17-25(26)9-1)39-32-13-5-7-15-34(32)40(35-16-8-6-14-33(35)39)30-19-20-31-36-22-27-11-3-4-12-28(27)23-38(36)41-37(31)24-30;1-2-13-26-25(11-1)12-9-19-27(26)35-23-37-31-17-6-4-15-29(31)36(24-38(37)30-16-5-3-14-28(30)35)34-21-10-20-33-32-18-7-8-22-39(32)41-40(33)34;1-2-10-23(11-3-1)30-21-32-28-15-7-5-13-26(28)31(22-33(32)27-14-6-4-12-25(27)30)24-18-19-36-34(20-24)29-16-8-9-17-35(29)37-36;1-2-10-23(11-3-1)31-21-33-28-15-7-5-13-26(28)32(22-34(33)27-14-6-4-12-25(27)31)24-18-19-30-29-16-8-9-17-35(29)37-36(30)20-24;1-2-11-23(12-3-1)31-21-33-27-16-7-6-15-26(27)32(22-34(33)25-14-5-4-13-24(25)31)30-19-10-18-29-28-17-8-9-20-35(28)37-36(29)30;1-2-11-23(12-3-1)30-21-32-27-16-7-6-15-26(27)31(22-33(32)25-14-5-4-13-24(25)30)28-18-10-20-35-36(28)29-17-8-9-19-34(29)37-35/h4*1-24H;4*1-22H.
What are the key properties of 1-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;2-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;3-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;4-(12-naphthalen-1-ylchrysen-6-yl)dibenzothiophene;1-(12-phenylchrysen-6-yl)dibenzothiophene;2-(12-phenylchrysen-6-yl)dibenzothiophene;3-(12-phenylchrysen-6-yl)dibenzothiophene;4-(12-phenylchrysen-6-yl)dibenzothiophene?
1-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;2-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;3-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;4-(12-naphthalen-1-ylchrysen-6-yl)dibenzothiophene;1-(12-phenylchrysen-6-yl)dibenzothiophene;2-(12-phenylchrysen-6-yl)dibenzothiophene;3-(12-phenylchrysen-6-yl)dibenzothiophene;4-(12-phenylchrysen-6-yl)dibenzothiophene has a molecular weight of 4045.15 g/mol, XLogP of 89.99, 16 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;2-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;3-(10-naphthalen-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;4-(12-naphthalen-1-ylchrysen-6-yl)dibenzothiophene;1-(12-phenylchrysen-6-yl)dibenzothiophene;2-(12-phenylchrysen-6-yl)dibenzothiophene;3-(12-phenylchrysen-6-yl)dibenzothiophene;4-(12-phenylchrysen-6-yl)dibenzothiophene is sourced from PubChem (CID 161005842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).