2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-9,9-dimethyl-4-phenylindeno[2,1-d]pyrimidine;4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-9,9-dimethyl-2-phenylindeno[2,1-d]pyrimidine;4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-2-phenyl-[1]benzothiolo[3,2-d]pyrimidine;2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-5-phenyl-1,3,4-oxadiazole;2-[3-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]phenyl]-4-phenyl-[1]benzothiolo[3,2-d]pyrimidine
C284H177N25O6S2 — CID 161212444
Data last refreshed: (MolForge compound catalog, from PubChem)
IUPAC2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-9,9-dimethyl-4-phenylindeno[2,1-d]pyrimidine;4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-9,9-dimethyl-2-phenylindeno[2,1-d]pyrimidine;4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-2-phenyl-[1]benzothiolo[3,2-d]pyrimidine;2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-5-phenyl-1,3,4-oxadiazole;2-[3-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]phenyl]-4-phenyl-[1]benzothiolo[3,2-d]pyrimidine
SMILESCC1(C)c2ccccc2-c2c(-c3cccc4c3C3(c5ccccc5Oc5ccccc53)c3c(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cccc3-4)nc(-c3ccccc3)nc21.CC1(C)c2ccccc2-c2c(-c3ccccc3)nc(-c3cccc4c3C3(c5ccccc5Oc5ccccc53)c3c(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cccc3-4)nc21.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3C3(c5ccccc5Oc5ccccc53)c3c(-c5cccc(-c6nc(-c7ccccc7)c7sc8ccccc8c7n6)c5)cccc3-4)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3C3(c5ccccc5Oc5ccccc53)c3c(-c5nnc(-c6ccccc6)o5)cccc3-4)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3C3(c5ccccc5Oc5ccccc53)c3c-4cccc3-c3nc(-c4ccccc4)nc4c3sc3ccccc34)n2)cc1
InChIInChI=1S/C62H37N5OS.2C59H39N5O.C56H33N5OS.C48H29N5O2/c1-4-19-38(20-5-1)55-57-56(46-27-10-15-36-52(46)69-57)64-60(63-55)42-26-16-25-41(37-42)43-28-17-29-44-45-30-18-31-47(61-66-58(39-21-6-2-7-22-39)65-59(67-61)40-23-8-3-9-24-40)54(45)62(53(43)44)48-32-11-13-34-50(48)68-51-35-14-12-33-49(51)62;1-58(2)44-31-13-12-26-41(44)49-52(60-54(61-53(49)58)36-20-6-3-7-21-36)42-29-18-27-39-40-28-19-30-43(57-63-55(37-22-8-4-9-23-37)62-56(64-57)38-24-10-5-11-25-38)51(40)59(50(39)42)45-32-14-16-34-47(45)65-48-35-17-15-33-46(48)59;1-58(2)44-31-13-12-26-41(44)49-52(36-20-6-3-7-21-36)60-56(61-53(49)58)42-29-18-27-39-40-28-19-30-43(57-63-54(37-22-8-4-9-23-37)62-55(64-57)38-24-10-5-11-25-38)51(40)59(50(39)42)45-32-14-16-34-47(45)65-48-35-17-15-33-46(48)59;1-4-18-34(19-5-1)52-57-49-39-24-10-15-33-46(39)63-51(49)50(58-52)40-27-16-25-37-38-26-17-28-41(55-60-53(35-20-6-2-7-21-35)59-54(61-55)36-22-8-3-9-23-36)48(38)56(47(37)40)42-29-11-13-31-44(42)62-45-32-14-12-30-43(45)56;1-4-16-30(17-5-1)43-49-44(31-18-6-2-7-19-31)51-45(50-43)35-24-14-22-33-34-23-15-25-36(47-53-52-46(55-47)32-20-8-3-9-21-32)42(34)48(41(33)35)37-26-10-12-28-39(37)54-40-29-13-11-27-38(40)48/h1-37H;2*3-35H,1-2H3;1-33H;1-29H
InChIKeyUWKMLUCTWLTKCN-UHFFFAOYSA-N
MW4099.84 g/mol
LogP67.94
Rot. Bonds26
About 2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-9,9-dimethyl-4-phenylindeno[2,1-d]pyrimidine;4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-9,9-dimethyl-2-phenylindeno[2,1-d]pyrimidine;4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-2-phenyl-[1]benzothiolo[3,2-d]pyrimidine;2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-5-phenyl-1,3,4-oxadiazole;2-[3-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]phenyl]-4-phenyl-[1]benzothiolo[3,2-d]pyrimidine
2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-9,9-dimethyl-4-phenylindeno[2,1-d]pyrimidine;4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-9,9-dimethyl-2-phenylindeno[2,1-d]pyrimidine;4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-2-phenyl-[1]benzothiolo[3,2-d]pyrimidine;2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-5-phenyl-1,3,4-oxadiazole;2-[3-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]phenyl]-4-phenyl-[1]benzothiolo[3,2-d]pyrimidine (PubChem CID 161212444) has the molecular formula C284H177N25O6S2 and a molecular weight of 4099.84 g/mol. Its IUPAC name is 2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-9,9-dimethyl-4-phenylindeno[2,1-d]pyrimidine;4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-9,9-dimethyl-2-phenylindeno[2,1-d]pyrimidine;4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-2-phenyl-[1]benzothiolo[3,2-d]pyrimidine;2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-5-phenyl-1,3,4-oxadiazole;2-[3-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]phenyl]-4-phenyl-[1]benzothiolo[3,2-d]pyrimidine.
Molecular Properties
| Compound Name | 2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-9,9-dimethyl-4-phenylindeno[2,1-d]pyrimidine;4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-9,9-dimethyl-2-phenylindeno[2,1-d]pyrimidine;4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-2-phenyl-[1]benzothiolo[3,2-d]pyrimidine;2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-5-phenyl-1,3,4-oxadiazole;2-[3-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]phenyl]-4-phenyl-[1]benzothiolo[3,2-d]pyrimidine |
|---|---|
| PubChem CID | 161212444 |
| Molecular Formula | C284H177N25O6S2 |
| Molecular Weight | 4099.84 g/mol |
| Exact Mass | 4096.38 |
| IUPAC Name | 2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-9,9-dimethyl-4-phenylindeno[2,1-d]pyrimidine;4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-9,9-dimethyl-2-phenylindeno[2,1-d]pyrimidine;4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-2-phenyl-[1]benzothiolo[3,2-d]pyrimidine;2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-5-phenyl-1,3,4-oxadiazole;2-[3-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]phenyl]-4-phenyl-[1]benzothiolo[3,2-d]pyrimidine |
| SMILES | CC1(C)c2ccccc2-c2c(-c3cccc4c3C3(c5ccccc5Oc5ccccc53)c3c(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cccc3-4)nc(-c3ccccc3)nc21.CC1(C)c2ccccc2-c2c(-c3ccccc3)nc(-c3cccc4c3C3(c5ccccc5Oc5ccccc53)c3c(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cccc3-4)nc21.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3C3(c5ccccc5Oc5ccccc53)c3c(-c5cccc(-c6nc(-c7ccccc7)c7sc8ccccc8c7n6)c5)cccc3-4)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3C3(c5ccccc5Oc5ccccc53)c3c(-c5nnc(-c6ccccc6)o5)cccc3-4)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3C3(c5ccccc5Oc5ccccc53)c3c-4cccc3-c3nc(-c4ccccc4)nc4c3sc3ccccc34)n2)cc1 |
| InChI | InChI=1S/C62H37N5OS.2C59H39N5O.C56H33N5OS.C48H29N5O2/c1-4-19-38(20-5-1)55-57-56(46-27-10-15-36-52(46)69-57)64-60(63-55)42-26-16-25-41(37-42)43-28-17-29-44-45-30-18-31-47(61-66-58(39-21-6-2-7-22-39)65-59(67-61)40-23-8-3-9-24-40)54(45)62(53(43)44)48-32-11-13-34-50(48)68-51-35-14-12-33-49(51)62;1-58(2)44-31-13-12-26-41(44)49-52(60-54(61-53(49)58)36-20-6-3-7-21-36)42-29-18-27-39-40-28-19-30-43(57-63-55(37-22-8-4-9-23-37)62-56(64-57)38-24-10-5-11-25-38)51(40)59(50(39)42)45-32-14-16-34-47(45)65-48-35-17-15-33-46(48)59;1-58(2)44-31-13-12-26-41(44)49-52(36-20-6-3-7-21-36)60-56(61-53(49)58)42-29-18-27-39-40-28-19-30-43(57-63-54(37-22-8-4-9-23-37)62-55(64-57)38-24-10-5-11-25-38)51(40)59(50(39)42)45-32-14-16-34-47(45)65-48-35-17-15-33-46(48)59;1-4-18-34(19-5-1)52-57-49-39-24-10-15-33-46(39)63-51(49)50(58-52)40-27-16-25-37-38-26-17-28-41(55-60-53(35-20-6-2-7-21-35)59-54(61-55)36-22-8-3-9-23-36)48(38)56(47(37)40)42-29-11-13-31-44(42)62-45-32-14-12-30-43(45)56;1-4-16-30(17-5-1)43-49-44(31-18-6-2-7-19-31)51-45(50-43)35-24-14-22-33-34-23-15-25-36(47-53-52-46(55-47)32-20-8-3-9-21-32)42(34)48(41(33)35)37-26-10-12-28-39(37)54-40-29-13-11-27-38(40)48/h1-37H;2*3-35H,1-2H3;1-33H;1-29H |
| InChIKey | UWKMLUCTWLTKCN-UHFFFAOYSA-N |
| XLogP | 67.94 |
| TPSA | 381.54 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 33 |
| Rotatable Bonds | 26 |
| Heavy Atoms | 317 |
| Complexity | — |
Lipinski Rule of Five
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 4099.84 |
| LogP ≤ 5 | 67.94 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 33 |
Frequently Asked Questions
What is the IUPAC name of 2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-9,9-dimethyl-4-phenylindeno[2,1-d]pyrimidine;4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-9,9-dimethyl-2-phenylindeno[2,1-d]pyrimidine;4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-2-phenyl-[1]benzothiolo[3,2-d]pyrimidine;2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-5-phenyl-1,3,4-oxadiazole;2-[3-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]phenyl]-4-phenyl-[1]benzothiolo[3,2-d]pyrimidine?
The IUPAC name of 2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-9,9-dimethyl-4-phenylindeno[2,1-d]pyrimidine;4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-9,9-dimethyl-2-phenylindeno[2,1-d]pyrimidine;4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-2-phenyl-[1]benzothiolo[3,2-d]pyrimidine;2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-5-phenyl-1,3,4-oxadiazole;2-[3-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]phenyl]-4-phenyl-[1]benzothiolo[3,2-d]pyrimidine (CID 161212444) is 2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-9,9-dimethyl-4-phenylindeno[2,1-d]pyrimidine;4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-9,9-dimethyl-2-phenylindeno[2,1-d]pyrimidine;4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-2-phenyl-[1]benzothiolo[3,2-d]pyrimidine;2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-5-phenyl-1,3,4-oxadiazole;2-[3-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]phenyl]-4-phenyl-[1]benzothiolo[3,2-d]pyrimidine.
What is the SMILES notation for 2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-9,9-dimethyl-4-phenylindeno[2,1-d]pyrimidine;4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-9,9-dimethyl-2-phenylindeno[2,1-d]pyrimidine;4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-2-phenyl-[1]benzothiolo[3,2-d]pyrimidine;2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-5-phenyl-1,3,4-oxadiazole;2-[3-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]phenyl]-4-phenyl-[1]benzothiolo[3,2-d]pyrimidine?
The canonical SMILES for 2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-9,9-dimethyl-4-phenylindeno[2,1-d]pyrimidine;4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-9,9-dimethyl-2-phenylindeno[2,1-d]pyrimidine;4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-2-phenyl-[1]benzothiolo[3,2-d]pyrimidine;2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-5-phenyl-1,3,4-oxadiazole;2-[3-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]phenyl]-4-phenyl-[1]benzothiolo[3,2-d]pyrimidine is CC1(C)c2ccccc2-c2c(-c3cccc4c3C3(c5ccccc5Oc5ccccc53)c3c(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cccc3-4)nc(-c3ccccc3)nc21.CC1(C)c2ccccc2-c2c(-c3ccccc3)nc(-c3cccc4c3C3(c5ccccc5Oc5ccccc53)c3c(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cccc3-4)nc21.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3C3(c5ccccc5Oc5ccccc53)c3c(-c5cccc(-c6nc(-c7ccccc7)c7sc8ccccc8c7n6)c5)cccc3-4)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3C3(c5ccccc5Oc5ccccc53)c3c(-c5nnc(-c6ccccc6)o5)cccc3-4)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3C3(c5ccccc5Oc5ccccc53)c3c-4cccc3-c3nc(-c4ccccc4)nc4c3sc3ccccc34)n2)cc1.
What is the InChIKey of 2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-9,9-dimethyl-4-phenylindeno[2,1-d]pyrimidine;4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-9,9-dimethyl-2-phenylindeno[2,1-d]pyrimidine;4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-2-phenyl-[1]benzothiolo[3,2-d]pyrimidine;2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-5-phenyl-1,3,4-oxadiazole;2-[3-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]phenyl]-4-phenyl-[1]benzothiolo[3,2-d]pyrimidine?
The InChIKey is UWKMLUCTWLTKCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C62H37N5OS.2C59H39N5O.C56H33N5OS.C48H29N5O2/c1-4-19-38(20-5-1)55-57-56(46-27-10-15-36-52(46)69-57)64-60(63-55)42-26-16-25-41(37-42)43-28-17-29-44-45-30-18-31-47(61-66-58(39-21-6-2-7-22-39)65-59(67-61)40-23-8-3-9-24-40)54(45)62(53(43)44)48-32-11-13-34-50(48)68-51-35-14-12-33-49(51)62;1-58(2)44-31-13-12-26-41(44)49-52(60-54(61-53(49)58)36-20-6-3-7-21-36)42-29-18-27-39-40-28-19-30-43(57-63-55(37-22-8-4-9-23-37)62-56(64-57)38-24-10-5-11-25-38)51(40)59(50(39)42)45-32-14-16-34-47(45)65-48-35-17-15-33-46(48)59;1-58(2)44-31-13-12-26-41(44)49-52(36-20-6-3-7-21-36)60-56(61-53(49)58)42-29-18-27-39-40-28-19-30-43(57-63-54(37-22-8-4-9-23-37)62-55(64-57)38-24-10-5-11-25-38)51(40)59(50(39)42)45-32-14-16-34-47(45)65-48-35-17-15-33-46(48)59;1-4-18-34(19-5-1)52-57-49-39-24-10-15-33-46(39)63-51(49)50(58-52)40-27-16-25-37-38-26-17-28-41(55-60-53(35-20-6-2-7-21-35)59-54(61-55)36-22-8-3-9-23-36)48(38)56(47(37)40)42-29-11-13-31-44(42)62-45-32-14-12-30-43(45)56;1-4-16-30(17-5-1)43-49-44(31-18-6-2-7-19-31)51-45(50-43)35-24-14-22-33-34-23-15-25-36(47-53-52-46(55-47)32-20-8-3-9-21-32)42(34)48(41(33)35)37-26-10-12-28-39(37)54-40-29-13-11-27-38(40)48/h1-37H;2*3-35H,1-2H3;1-33H;1-29H.
What are the key properties of 2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-9,9-dimethyl-4-phenylindeno[2,1-d]pyrimidine;4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-9,9-dimethyl-2-phenylindeno[2,1-d]pyrimidine;4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-2-phenyl-[1]benzothiolo[3,2-d]pyrimidine;2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-5-phenyl-1,3,4-oxadiazole;2-[3-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]phenyl]-4-phenyl-[1]benzothiolo[3,2-d]pyrimidine?
2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-9,9-dimethyl-4-phenylindeno[2,1-d]pyrimidine;4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-9,9-dimethyl-2-phenylindeno[2,1-d]pyrimidine;4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-2-phenyl-[1]benzothiolo[3,2-d]pyrimidine;2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-5-phenyl-1,3,4-oxadiazole;2-[3-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]phenyl]-4-phenyl-[1]benzothiolo[3,2-d]pyrimidine has a molecular weight of 4099.84 g/mol, XLogP of 67.94, 26 rotatable bonds, 0 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-9,9-dimethyl-4-phenylindeno[2,1-d]pyrimidine;4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-9,9-dimethyl-2-phenylindeno[2,1-d]pyrimidine;4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-2-phenyl-[1]benzothiolo[3,2-d]pyrimidine;2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]-5-phenyl-1,3,4-oxadiazole;2-[3-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,9'-xanthene]-1-yl]phenyl]-4-phenyl-[1]benzothiolo[3,2-d]pyrimidine is sourced from PubChem (CID 161212444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).
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Sources
- PubChem CID 161212444 — identifiers, structure, computed properties (public domain)
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