bis(3-[9,9-dimethyl-6-(10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl)fluoren-3-yl]-10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzofuran-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzothiophen-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole)

C390H264N12O2S14 — CID 162233630

IUPACbis(3-[9,9-dimethyl-6-(10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl)fluoren-3-yl]-10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzofuran-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzothiophen-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole)
SMILESCC1(C)c2ccc(-c3ccc4c(c3)C3Sc5ccccc5C3N4c3ccccc3)cc2-c2cc(-c3ccc4c(c3)C3Sc5ccccc5C3N4c3cc(-c4ccccc4)cc(-c4ccccc4)c3)ccc21.CC1(C)c2ccc(-c3ccc4c(c3)C3Sc5ccccc5C3N4c3ccccc3)cc2-c2cc(-c3ccc4c(c3)C3Sc5ccccc5C3N4c3cc(-c4ccccc4)cc(-c4ccccc4)c3)ccc21.c1ccc(-c2cc(-c3ccccc3)cc(N3c4ccc(-c5ccc6oc7ccc(-c8ccc9c(c8)C8Sc%10ccccc%10C8N9c8ccccc8)cc7c6c5)cc4C4Sc5ccccc5C43)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(N3c4ccc(-c5ccc6oc7ccc(-c8ccc9c(c8)C8Sc%10ccccc%10C8N9c8ccccc8)cc7c6c5)cc4C4Sc5ccccc5C43)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(N3c4ccc(-c5ccc6sc7ccc(-c8ccc9c(c8)C8Sc%10ccccc%10C8N9c8ccccc8)cc7c6c5)cc4C4Sc5ccccc5C43)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(N3c4ccc(-c5ccc6sc7ccc(-c8ccc9c(c8)C8Sc%10ccccc%10C8N9c8ccccc8)cc7c6c5)cc4C4Sc5ccccc5C43)c2)cc1
InChIInChI=1S/2C67H48N2S2.2C64H42N2OS2.2C64H42N2S3/c2*1-67(2)57-30-26-43(45-28-32-59-55(39-45)65-63(51-22-12-14-24-61(51)70-65)68(59)49-20-10-5-11-21-49)37-53(57)54-38-44(27-31-58(54)67)46-29-33-60-56(40-46)66-64(52-23-13-15-25-62(52)71-66)69(60)50-35-47(41-16-6-3-7-17-41)34-48(36-50)42-18-8-4-9-19-42;2*1-4-14-39(15-5-1)45-32-46(40-16-6-2-7-17-40)34-48(33-45)66-56-29-25-42(38-54(56)64-62(66)50-21-11-13-23-60(50)69-64)44-27-31-58-52(36-44)51-35-43(26-30-57(51)67-58)41-24-28-55-53(37-41)63-61(49-20-10-12-22-59(49)68-63)65(55)47-18-8-3-9-19-47;2*1-4-14-39(15-5-1)45-32-46(40-16-6-2-7-17-40)34-48(33-45)66-56-29-25-42(38-54(56)64-62(66)50-21-11-13-23-58(50)69-64)44-27-31-60-52(36-44)51-35-43(26-30-59(51)67-60)41-24-28-55-53(37-41)63-61(49-20-10-12-22-57(49)68-63)65(55)47-18-8-3-9-19-47/h2*3-40,63-66H,1-2H3;4*1-38,61-64H
InChIKeyZVTSIRRQLSTFLV-UHFFFAOYSA-N
MW5599.42 g/mol
LogP111.75
Rot. Bonds36

About bis(3-[9,9-dimethyl-6-(10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl)fluoren-3-yl]-10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzofuran-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzothiophen-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole)

bis(3-[9,9-dimethyl-6-(10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl)fluoren-3-yl]-10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzofuran-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzothiophen-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole) (PubChem CID 162233630) has the molecular formula C390H264N12O2S14 and a molecular weight of 5599.42 g/mol. Its IUPAC name is bis(3-[9,9-dimethyl-6-(10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl)fluoren-3-yl]-10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzofuran-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzothiophen-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole).

Molecular Properties

Compound Namebis(3-[9,9-dimethyl-6-(10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl)fluoren-3-yl]-10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzofuran-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzothiophen-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole)
PubChem CID162233630
Molecular FormulaC390H264N12O2S14
Molecular Weight5599.42 g/mol
Exact Mass5593.70
IUPAC Namebis(3-[9,9-dimethyl-6-(10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl)fluoren-3-yl]-10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzofuran-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzothiophen-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole)
SMILESCC1(C)c2ccc(-c3ccc4c(c3)C3Sc5ccccc5C3N4c3ccccc3)cc2-c2cc(-c3ccc4c(c3)C3Sc5ccccc5C3N4c3cc(-c4ccccc4)cc(-c4ccccc4)c3)ccc21.CC1(C)c2ccc(-c3ccc4c(c3)C3Sc5ccccc5C3N4c3ccccc3)cc2-c2cc(-c3ccc4c(c3)C3Sc5ccccc5C3N4c3cc(-c4ccccc4)cc(-c4ccccc4)c3)ccc21.c1ccc(-c2cc(-c3ccccc3)cc(N3c4ccc(-c5ccc6oc7ccc(-c8ccc9c(c8)C8Sc%10ccccc%10C8N9c8ccccc8)cc7c6c5)cc4C4Sc5ccccc5C43)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(N3c4ccc(-c5ccc6oc7ccc(-c8ccc9c(c8)C8Sc%10ccccc%10C8N9c8ccccc8)cc7c6c5)cc4C4Sc5ccccc5C43)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(N3c4ccc(-c5ccc6sc7ccc(-c8ccc9c(c8)C8Sc%10ccccc%10C8N9c8ccccc8)cc7c6c5)cc4C4Sc5ccccc5C43)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(N3c4ccc(-c5ccc6sc7ccc(-c8ccc9c(c8)C8Sc%10ccccc%10C8N9c8ccccc8)cc7c6c5)cc4C4Sc5ccccc5C43)c2)cc1
InChIInChI=1S/2C67H48N2S2.2C64H42N2OS2.2C64H42N2S3/c2*1-67(2)57-30-26-43(45-28-32-59-55(39-45)65-63(51-22-12-14-24-61(51)70-65)68(59)49-20-10-5-11-21-49)37-53(57)54-38-44(27-31-58(54)67)46-29-33-60-56(40-46)66-64(52-23-13-15-25-62(52)71-66)69(60)50-35-47(41-16-6-3-7-17-41)34-48(36-50)42-18-8-4-9-19-42;2*1-4-14-39(15-5-1)45-32-46(40-16-6-2-7-17-40)34-48(33-45)66-56-29-25-42(38-54(56)64-62(66)50-21-11-13-23-60(50)69-64)44-27-31-58-52(36-44)51-35-43(26-30-57(51)67-58)41-24-28-55-53(37-41)63-61(49-20-10-12-22-59(49)68-63)65(55)47-18-8-3-9-19-47;2*1-4-14-39(15-5-1)45-32-46(40-16-6-2-7-17-40)34-48(33-45)66-56-29-25-42(38-54(56)64-62(66)50-21-11-13-23-58(50)69-64)44-27-31-60-52(36-44)51-35-43(26-30-59(51)67-60)41-24-28-55-53(37-41)63-61(49-20-10-12-22-57(49)68-63)65(55)47-18-8-3-9-19-47/h2*3-40,63-66H,1-2H3;4*1-38,61-64H
InChIKeyZVTSIRRQLSTFLV-UHFFFAOYSA-N
XLogP111.75
TPSA65.16 Ų
H-Bond Donors
H-Bond Acceptors28
Rotatable Bonds36
Heavy Atoms418
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005599.42
LogP ≤ 5111.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1028

Analyze bis(3-[9,9-dimethyl-6-(10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl)fluoren-3-yl]-10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzofuran-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzothiophen-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole) with MolForge

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Related Compounds

3-[6-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]-9-phenylcarbazol-3-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole
CID 121285667
3-(9-dibenzofuran-2-ylcarbazol-3-yl)-9-(3-phenylphenyl)carbazole;3-(9-dibenzothiophen-2-ylcarbazol-3-yl)-9-(3-phenylphenyl)carbazole;3-[9-(9,9-dimethylfluoren-3-yl)carbazol-3-yl]-9-(3,5-diphenylphenyl)carbazole
CID 159392904
3-[4-(9-dibenzofuran-2-ylcarbazol-3-yl)phenyl]-9-phenylcarbazole;3-[4-(9-dibenzothiophen-2-ylcarbazol-3-yl)phenyl]-9-phenylcarbazole;3-[4-[9-(9,9-dimethylfluoren-3-yl)carbazol-3-yl]phenyl]-9-phenylcarbazole;3-[3-[9-(3,5-diphenylphenyl)carbazol-3-yl]phenyl]-9-phenylcarbazole;9-(3-phenylphenyl)-3-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]carbazole
CID 159640666
3,9-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-dibenzofuran-2-ylcarbazol-3-yl)-9-(3-phenylphenyl)carbazole;3-(9-dibenzothiophen-2-ylcarbazol-3-yl)-9-(3-phenylphenyl)carbazole;3-[9-(9,9-dimethylfluoren-3-yl)carbazol-3-yl]-9-(3,5-diphenylphenyl)carbazole;3-[9-(9,9-dimethylfluoren-3-yl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole
CID 162097761
9-[3-[6-(8-carbazol-9-yldibenzofuran-2-yl)-9,9-dimethylfluoren-2-yl]-5-phenylphenyl]carbazole
CID 71278034
3-[4-(9-dibenzofuran-2-ylcarbazol-3-yl)phenyl]-9-phenylcarbazole;3-[4-(9-dibenzothiophen-2-ylcarbazol-3-yl)phenyl]-9-phenylcarbazole;3-[4-[9-(9,9-dimethylfluoren-3-yl)carbazol-3-yl]phenyl]-9-phenylcarbazole;3-[3-[9-(3,5-diphenylphenyl)carbazol-3-yl]phenyl]-9-phenylcarbazole;9-phenyl-2-[3-(9-phenylcarbazol-3-yl)phenyl]carbazole;9-phenyl-3-[3-(9-phenylcarbazol-3-yl)phenyl]carbazole;9-phenyl-3-[2-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]carbazole;9-(3-phenylphenyl)-3-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]carbazole
CID 159748904
3-[8-[10-(4,6-diphenylpyrimidin-2-yl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzothiophen-2-yl]-10-phenyl-[1]benzothiolo[3,2-b]indole
CID 121287789
10-[3-(3-dibenzothiophen-2-ylphenyl)phenyl]-9,9-dimethyl-2,7-diphenylacridine
CID 71003882
2,9-bis[3-(3,5-diphenylphenyl)phenyl]-7,7-dimethylfluoreno[2,3-b][1]benzothiole
CID 88889286
N-(9,9-dimethylfluoren-2-yl)-16-phenyl-N-(4-phenylphenyl)-10-oxa-20-thiapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14(19),15,17-nonaen-6-amine
CID 171050212
2-dibenzofuran-2-yl-9-(3-triphenylen-2-ylphenyl)carbazole;2-dibenzothiophen-2-yl-9-(3-triphenylen-2-ylphenyl)carbazole;3-[9-(9,9-dimethylfluoren-2-yl)carbazol-2-yl]-9-(4-phenylphenyl)carbazole;3,6-diphenyl-9-(3-triphenylen-2-ylphenyl)carbazole;2-(9-phenylcarbazol-3-yl)-9-(3-triphenylen-2-ylphenyl)carbazole;3-(9-phenylcarbazol-2-yl)-9-(3-triphenylen-2-ylphenyl)carbazole;3-(9-phenylcarbazol-3-yl)-9-(3-triphenylen-2-ylphenyl)carbazole
CID 158234145
10-[3-(3-dibenzofuran-2-ylphenyl)phenyl]-9,9-dimethyl-2-phenylacridine
CID 71003986

Frequently Asked Questions

What is the IUPAC name of bis(3-[9,9-dimethyl-6-(10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl)fluoren-3-yl]-10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzofuran-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzothiophen-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole)?
The IUPAC name of bis(3-[9,9-dimethyl-6-(10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl)fluoren-3-yl]-10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzofuran-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzothiophen-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole) (CID 162233630) is bis(3-[9,9-dimethyl-6-(10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl)fluoren-3-yl]-10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzofuran-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzothiophen-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole).
What is the SMILES notation for bis(3-[9,9-dimethyl-6-(10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl)fluoren-3-yl]-10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzofuran-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzothiophen-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole)?
The canonical SMILES for bis(3-[9,9-dimethyl-6-(10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl)fluoren-3-yl]-10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzofuran-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzothiophen-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole) is CC1(C)c2ccc(-c3ccc4c(c3)C3Sc5ccccc5C3N4c3ccccc3)cc2-c2cc(-c3ccc4c(c3)C3Sc5ccccc5C3N4c3cc(-c4ccccc4)cc(-c4ccccc4)c3)ccc21.CC1(C)c2ccc(-c3ccc4c(c3)C3Sc5ccccc5C3N4c3ccccc3)cc2-c2cc(-c3ccc4c(c3)C3Sc5ccccc5C3N4c3cc(-c4ccccc4)cc(-c4ccccc4)c3)ccc21.c1ccc(-c2cc(-c3ccccc3)cc(N3c4ccc(-c5ccc6oc7ccc(-c8ccc9c(c8)C8Sc%10ccccc%10C8N9c8ccccc8)cc7c6c5)cc4C4Sc5ccccc5C43)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(N3c4ccc(-c5ccc6oc7ccc(-c8ccc9c(c8)C8Sc%10ccccc%10C8N9c8ccccc8)cc7c6c5)cc4C4Sc5ccccc5C43)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(N3c4ccc(-c5ccc6sc7ccc(-c8ccc9c(c8)C8Sc%10ccccc%10C8N9c8ccccc8)cc7c6c5)cc4C4Sc5ccccc5C43)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(N3c4ccc(-c5ccc6sc7ccc(-c8ccc9c(c8)C8Sc%10ccccc%10C8N9c8ccccc8)cc7c6c5)cc4C4Sc5ccccc5C43)c2)cc1.
What is the InChIKey of bis(3-[9,9-dimethyl-6-(10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl)fluoren-3-yl]-10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzofuran-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzothiophen-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole)?
The InChIKey is ZVTSIRRQLSTFLV-UHFFFAOYSA-N. The full InChI is InChI=1S/2C67H48N2S2.2C64H42N2OS2.2C64H42N2S3/c2*1-67(2)57-30-26-43(45-28-32-59-55(39-45)65-63(51-22-12-14-24-61(51)70-65)68(59)49-20-10-5-11-21-49)37-53(57)54-38-44(27-31-58(54)67)46-29-33-60-56(40-46)66-64(52-23-13-15-25-62(52)71-66)69(60)50-35-47(41-16-6-3-7-17-41)34-48(36-50)42-18-8-4-9-19-42;2*1-4-14-39(15-5-1)45-32-46(40-16-6-2-7-17-40)34-48(33-45)66-56-29-25-42(38-54(56)64-62(66)50-21-11-13-23-60(50)69-64)44-27-31-58-52(36-44)51-35-43(26-30-57(51)67-58)41-24-28-55-53(37-41)63-61(49-20-10-12-22-59(49)68-63)65(55)47-18-8-3-9-19-47;2*1-4-14-39(15-5-1)45-32-46(40-16-6-2-7-17-40)34-48(33-45)66-56-29-25-42(38-54(56)64-62(66)50-21-11-13-23-58(50)69-64)44-27-31-60-52(36-44)51-35-43(26-30-59(51)67-60)41-24-28-55-53(37-41)63-61(49-20-10-12-22-57(49)68-63)65(55)47-18-8-3-9-19-47/h2*3-40,63-66H,1-2H3;4*1-38,61-64H.
What are the key properties of bis(3-[9,9-dimethyl-6-(10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl)fluoren-3-yl]-10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzofuran-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzothiophen-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole)?
bis(3-[9,9-dimethyl-6-(10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl)fluoren-3-yl]-10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzofuran-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzothiophen-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole) has a molecular weight of 5599.42 g/mol, XLogP of 111.75, 36 rotatable bonds, 0 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for bis(3-[9,9-dimethyl-6-(10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl)fluoren-3-yl]-10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzofuran-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole);bis(3-[8-[10-(3,5-diphenylphenyl)-4b,9b-dihydro-[1]benzothiolo[3,2-b]indol-3-yl]dibenzothiophen-2-yl]-10-phenyl-4b,9b-dihydro-[1]benzothiolo[3,2-b]indole) is sourced from PubChem (CID 162233630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).