11-[4-dibenzofuran-3-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-2,5-diphenyl-[1]benzothiolo[3,2-c]carbazole

C153H90N12O3S3 — CID 158699020

IUPAC11-[4-dibenzofuran-3-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-2,5-diphenyl-[1]benzothiolo[3,2-c]carbazole
SMILESc1ccc(-c2ccc(-c3nc(-c4cccc5c4oc4ccccc45)nc(-c4cccc5c4sc4c5ccc5c4c4ccccc4n5-c4ccccc4)n3)cc2)cc1.c1ccc(-c2ccc3c(c2)c2c4sc5c(-c6nc(-c7ccccc7)nc(-c7cccc8oc9ccccc9c78)n6)cccc5c4ccc2n3-c2ccccc2)cc1.c1ccc(-c2cccc(-c3nc(-c4ccc5c(c4)oc4ccccc45)nc(-c4cccc5c4sc4c5ccc5c4c4ccccc4n5-c4ccccc4)n3)c2)cc1
InChIInChI=1S/3C51H30N4OS/c1-4-14-31(15-5-1)33-26-28-41-40(30-33)46-42(55(41)34-18-8-3-9-19-34)29-27-36-35-21-12-23-39(47(35)57-48(36)46)51-53-49(32-16-6-2-7-17-32)52-50(54-51)38-22-13-25-44-45(38)37-20-10-11-24-43(37)56-44;1-3-13-31(14-4-1)32-15-11-16-33(29-32)49-52-50(34-25-26-37-36-19-8-10-24-44(36)56-45(37)30-34)54-51(53-49)41-22-12-21-38-39-27-28-43-46(48(39)57-47(38)41)40-20-7-9-23-42(40)55(43)35-17-5-2-6-18-35;1-3-13-31(14-4-1)32-25-27-33(28-26-32)49-52-50(40-21-11-19-36-35-17-8-10-24-44(35)56-46(36)40)54-51(53-49)41-22-12-20-37-38-29-30-43-45(48(38)57-47(37)41)39-18-7-9-23-42(39)55(43)34-15-5-2-6-16-34/h3*1-30H
InChIKeyIHHLDGNHKTZBCI-UHFFFAOYSA-N
MW2240.68 g/mol
LogP41.71
Rot. Bonds15

About 11-[4-dibenzofuran-3-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-2,5-diphenyl-[1]benzothiolo[3,2-c]carbazole

11-[4-dibenzofuran-3-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-2,5-diphenyl-[1]benzothiolo[3,2-c]carbazole (PubChem CID 158699020) has the molecular formula C153H90N12O3S3 and a molecular weight of 2240.68 g/mol. Its IUPAC name is 11-[4-dibenzofuran-3-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-2,5-diphenyl-[1]benzothiolo[3,2-c]carbazole.

Molecular Properties

Compound Name11-[4-dibenzofuran-3-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-2,5-diphenyl-[1]benzothiolo[3,2-c]carbazole
PubChem CID158699020
Molecular FormulaC153H90N12O3S3
Molecular Weight2240.68 g/mol
Exact Mass2238.64
IUPAC Name11-[4-dibenzofuran-3-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-2,5-diphenyl-[1]benzothiolo[3,2-c]carbazole
SMILESc1ccc(-c2ccc(-c3nc(-c4cccc5c4oc4ccccc45)nc(-c4cccc5c4sc4c5ccc5c4c4ccccc4n5-c4ccccc4)n3)cc2)cc1.c1ccc(-c2ccc3c(c2)c2c4sc5c(-c6nc(-c7ccccc7)nc(-c7cccc8oc9ccccc9c78)n6)cccc5c4ccc2n3-c2ccccc2)cc1.c1ccc(-c2cccc(-c3nc(-c4ccc5c(c4)oc4ccccc45)nc(-c4cccc5c4sc4c5ccc5c4c4ccccc4n5-c4ccccc4)n3)c2)cc1
InChIInChI=1S/3C51H30N4OS/c1-4-14-31(15-5-1)33-26-28-41-40(30-33)46-42(55(41)34-18-8-3-9-19-34)29-27-36-35-21-12-23-39(47(35)57-48(36)46)51-53-49(32-16-6-2-7-17-32)52-50(54-51)38-22-13-25-44-45(38)37-20-10-11-24-43(37)56-44;1-3-13-31(14-4-1)32-15-11-16-33(29-32)49-52-50(34-25-26-37-36-19-8-10-24-44(36)56-45(37)30-34)54-51(53-49)41-22-12-21-38-39-27-28-43-46(48(39)57-47(38)41)40-20-7-9-23-42(40)55(43)35-17-5-2-6-18-35;1-3-13-31(14-4-1)32-25-27-33(28-26-32)49-52-50(40-21-11-19-36-35-17-8-10-24-44(35)56-46(36)40)54-51(53-49)41-22-12-20-37-38-29-30-43-45(48(38)57-47(37)41)39-18-7-9-23-42(39)55(43)34-15-5-2-6-16-34/h3*1-30H
InChIKeyIHHLDGNHKTZBCI-UHFFFAOYSA-N
XLogP41.71
TPSA170.22 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds15
Heavy Atoms171
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002240.68
LogP ≤ 541.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Analyze 11-[4-dibenzofuran-3-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-2,5-diphenyl-[1]benzothiolo[3,2-c]carbazole with MolForge

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Related Compounds

2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-5-phenyl-[1]benzofuro[3,2-c]carbazole;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;5-phenyl-2-[9-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-[1]benzofuro[3,2-c]carbazole
CID 161435526
2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-phenyl-[1]benzofuro[3,2-c]carbazole;2-(9,20-dithiapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14,16,18-nonaen-7-yl)-4,6-diphenyl-1,3,5-triazine
CID 161097020
2-dibenzofuran-3-yl-11-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenyl-[1]benzofuro[3,2-c]carbazole
CID 146541281
3-[9-[4-dibenzofuran-3-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-3-yl]-6,9-diphenylcarbazole
CID 168768312
9-phenyl-3-[9-[4-phenyl-6-(6-phenyldibenzothiophen-4-yl)-1,3,5-triazin-2-yl]dibenzofuran-2-yl]carbazole
CID 129291950
3-[7-[4-[8-[4-[4-dibenzofuran-3-yl-6-[7-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzofuran-4-yl]-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-3-yl]-9-phenylcarbazole
CID 170140037
9-phenyl-2-[6-[4-phenyl-6-(9-phenyldibenzofuran-3-yl)-1,3,5-triazin-2-yl]dibenzofuran-3-yl]carbazole
CID 155477559
9-[4-dibenzofuran-1-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;4-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)carbazole
CID 164984406
3-[3-[3-[9-[4-(4-dibenzofuran-3-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-2-yl]phenyl]phenyl]-9-phenylcarbazole
CID 168768477
3,9-diphenyl-6-[9-[4-phenyl-6-(7-phenyldibenzofuran-3-yl)-1,3,5-triazin-2-yl]dibenzofuran-3-yl]carbazole
CID 168768081
9-phenyl-3-[4-[9-[4-phenyl-6-(9-phenyldibenzofuran-3-yl)-1,3,5-triazin-2-yl]dibenzofuran-2-yl]phenyl]carbazole
CID 168767881
5-phenyl-10-[4-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-[1]benzofuro[3,2-c]carbazole
CID 163942946

Frequently Asked Questions

What is the IUPAC name of 11-[4-dibenzofuran-3-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-2,5-diphenyl-[1]benzothiolo[3,2-c]carbazole?
The IUPAC name of 11-[4-dibenzofuran-3-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-2,5-diphenyl-[1]benzothiolo[3,2-c]carbazole (CID 158699020) is 11-[4-dibenzofuran-3-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-2,5-diphenyl-[1]benzothiolo[3,2-c]carbazole.
What is the SMILES notation for 11-[4-dibenzofuran-3-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-2,5-diphenyl-[1]benzothiolo[3,2-c]carbazole?
The canonical SMILES for 11-[4-dibenzofuran-3-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-2,5-diphenyl-[1]benzothiolo[3,2-c]carbazole is c1ccc(-c2ccc(-c3nc(-c4cccc5c4oc4ccccc45)nc(-c4cccc5c4sc4c5ccc5c4c4ccccc4n5-c4ccccc4)n3)cc2)cc1.c1ccc(-c2ccc3c(c2)c2c4sc5c(-c6nc(-c7ccccc7)nc(-c7cccc8oc9ccccc9c78)n6)cccc5c4ccc2n3-c2ccccc2)cc1.c1ccc(-c2cccc(-c3nc(-c4ccc5c(c4)oc4ccccc45)nc(-c4cccc5c4sc4c5ccc5c4c4ccccc4n5-c4ccccc4)n3)c2)cc1.
What is the InChIKey of 11-[4-dibenzofuran-3-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-2,5-diphenyl-[1]benzothiolo[3,2-c]carbazole?
The InChIKey is IHHLDGNHKTZBCI-UHFFFAOYSA-N. The full InChI is InChI=1S/3C51H30N4OS/c1-4-14-31(15-5-1)33-26-28-41-40(30-33)46-42(55(41)34-18-8-3-9-19-34)29-27-36-35-21-12-23-39(47(35)57-48(36)46)51-53-49(32-16-6-2-7-17-32)52-50(54-51)38-22-13-25-44-45(38)37-20-10-11-24-43(37)56-44;1-3-13-31(14-4-1)32-15-11-16-33(29-32)49-52-50(34-25-26-37-36-19-8-10-24-44(36)56-45(37)30-34)54-51(53-49)41-22-12-21-38-39-27-28-43-46(48(39)57-47(38)41)40-20-7-9-23-42(40)55(43)35-17-5-2-6-18-35;1-3-13-31(14-4-1)32-25-27-33(28-26-32)49-52-50(40-21-11-19-36-35-17-8-10-24-44(35)56-46(36)40)54-51(53-49)41-22-12-20-37-38-29-30-43-45(48(38)57-47(37)41)39-18-7-9-23-42(39)55(43)34-15-5-2-6-16-34/h3*1-30H.
What are the key properties of 11-[4-dibenzofuran-3-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-2,5-diphenyl-[1]benzothiolo[3,2-c]carbazole?
11-[4-dibenzofuran-3-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-2,5-diphenyl-[1]benzothiolo[3,2-c]carbazole has a molecular weight of 2240.68 g/mol, XLogP of 41.71, 15 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 11-[4-dibenzofuran-3-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-5-phenyl-[1]benzothiolo[3,2-c]carbazole;11-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-2,5-diphenyl-[1]benzothiolo[3,2-c]carbazole is sourced from PubChem (CID 158699020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).