2-[4-(11,11-diphenylbenzo[b]fluoren-3-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-1-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-4-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(2-ethylhexoxy)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazin-2-yl]phenol

C172H156N12O8 — CID 164961041

IUPAC2-[4-(11,11-diphenylbenzo[b]fluoren-3-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-1-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-4-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(2-ethylhexoxy)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazin-2-yl]phenol
SMILESCCCCC(CC)COc1nc(-c2ccc3c(c2)-c2cc4ccccc4cc2C3(c2ccccc2)c2ccccc2)nc(-c2ccccc2O)n1.CCCCC(CC)COc1nc(-c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2ccccc2-3)nc(-c2ccccc2O)n1.CCCCC(CC)COc1nc(-c2ccccc2O)nc(-c2cccc3c2-c2ccccc2C3(c2ccccc2)c2ccccc2)n1.CCCCC(CC)COc1nc(-c2ccccc2O)nc(-c2cccc3c2C(c2ccccc2)(c2ccccc2)c2ccccc2-3)n1
InChIInChI=1S/C46H41N3O2.C42H37N3O2.2C42H39N3O2/c1-3-5-16-31(4-2)30-51-45-48-43(47-44(49-45)37-23-14-15-24-42(37)50)34-25-26-40-38(28-34)39-27-32-17-12-13-18-33(32)29-41(39)46(40,35-19-8-6-9-20-35)36-21-10-7-11-22-36;1-3-5-14-27(4-2)26-47-41-44-39(43-40(45-41)33-18-9-13-22-38(33)46)28-23-24-32-31-17-8-12-21-36(31)42(37(32)25-28)34-19-10-6-15-29(34)30-16-7-11-20-35(30)42;1-3-5-17-29(4-2)28-47-41-44-39(34-23-13-15-27-37(34)46)43-40(45-41)35-25-16-24-33-32-22-12-14-26-36(32)42(38(33)35,30-18-8-6-9-19-30)31-20-10-7-11-21-31;1-3-5-17-29(4-2)28-47-41-44-39(33-23-13-15-27-37(33)46)43-40(45-41)34-24-16-26-36-38(34)32-22-12-14-25-35(32)42(36,30-18-8-6-9-19-30)31-20-10-7-11-21-31/h6-15,17-29,31,50H,3-5,16,30H2,1-2H3;6-13,15-25,27,46H,3-5,14,26H2,1-2H3;2*6-16,18-27,29,46H,3-5,17,28H2,1-2H3
InChIKeyBVNDQVCFCITOFX-UHFFFAOYSA-N
MW2519.22 g/mol
LogP40.61
Rot. Bonds42

About 2-[4-(11,11-diphenylbenzo[b]fluoren-3-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-1-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-4-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(2-ethylhexoxy)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazin-2-yl]phenol

2-[4-(11,11-diphenylbenzo[b]fluoren-3-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-1-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-4-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(2-ethylhexoxy)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazin-2-yl]phenol (PubChem CID 164961041) has the molecular formula C172H156N12O8 and a molecular weight of 2519.22 g/mol. Its IUPAC name is 2-[4-(11,11-diphenylbenzo[b]fluoren-3-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-1-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-4-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(2-ethylhexoxy)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazin-2-yl]phenol.

Molecular Properties

Compound Name2-[4-(11,11-diphenylbenzo[b]fluoren-3-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-1-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-4-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(2-ethylhexoxy)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazin-2-yl]phenol
PubChem CID164961041
Molecular FormulaC172H156N12O8
Molecular Weight2519.22 g/mol
Exact Mass2517.22
IUPAC Name2-[4-(11,11-diphenylbenzo[b]fluoren-3-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-1-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-4-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(2-ethylhexoxy)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazin-2-yl]phenol
SMILESCCCCC(CC)COc1nc(-c2ccc3c(c2)-c2cc4ccccc4cc2C3(c2ccccc2)c2ccccc2)nc(-c2ccccc2O)n1.CCCCC(CC)COc1nc(-c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2ccccc2-3)nc(-c2ccccc2O)n1.CCCCC(CC)COc1nc(-c2ccccc2O)nc(-c2cccc3c2-c2ccccc2C3(c2ccccc2)c2ccccc2)n1.CCCCC(CC)COc1nc(-c2ccccc2O)nc(-c2cccc3c2C(c2ccccc2)(c2ccccc2)c2ccccc2-3)n1
InChIInChI=1S/C46H41N3O2.C42H37N3O2.2C42H39N3O2/c1-3-5-16-31(4-2)30-51-45-48-43(47-44(49-45)37-23-14-15-24-42(37)50)34-25-26-40-38(28-34)39-27-32-17-12-13-18-33(32)29-41(39)46(40,35-19-8-6-9-20-35)36-21-10-7-11-22-36;1-3-5-14-27(4-2)26-47-41-44-39(43-40(45-41)33-18-9-13-22-38(33)46)28-23-24-32-31-17-8-12-21-36(31)42(37(32)25-28)34-19-10-6-15-29(34)30-16-7-11-20-35(30)42;1-3-5-17-29(4-2)28-47-41-44-39(34-23-13-15-27-37(34)46)43-40(45-41)35-25-16-24-33-32-22-12-14-26-36(32)42(38(33)35,30-18-8-6-9-19-30)31-20-10-7-11-21-31;1-3-5-17-29(4-2)28-47-41-44-39(33-23-13-15-27-37(33)46)43-40(45-41)34-24-16-26-36-38(34)32-22-12-14-25-35(32)42(36,30-18-8-6-9-19-30)31-20-10-7-11-21-31/h6-15,17-29,31,50H,3-5,16,30H2,1-2H3;6-13,15-25,27,46H,3-5,14,26H2,1-2H3;2*6-16,18-27,29,46H,3-5,17,28H2,1-2H3
InChIKeyBVNDQVCFCITOFX-UHFFFAOYSA-N
XLogP40.61
TPSA272.52 Ų
H-Bond Donors4
H-Bond Acceptors20
Rotatable Bonds42
Heavy Atoms192
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002519.22
LogP ≤ 540.61
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1020

Analyze 2-[4-(11,11-diphenylbenzo[b]fluoren-3-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-1-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-4-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(2-ethylhexoxy)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazin-2-yl]phenol with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(11,11-diphenylbenzo[b]fluoren-3-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-1-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-4-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(2-ethylhexoxy)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazin-2-yl]phenol?
The IUPAC name of 2-[4-(11,11-diphenylbenzo[b]fluoren-3-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-1-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-4-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(2-ethylhexoxy)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazin-2-yl]phenol (CID 164961041) is 2-[4-(11,11-diphenylbenzo[b]fluoren-3-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-1-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-4-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(2-ethylhexoxy)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazin-2-yl]phenol.
What is the SMILES notation for 2-[4-(11,11-diphenylbenzo[b]fluoren-3-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-1-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-4-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(2-ethylhexoxy)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazin-2-yl]phenol?
The canonical SMILES for 2-[4-(11,11-diphenylbenzo[b]fluoren-3-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-1-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-4-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(2-ethylhexoxy)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazin-2-yl]phenol is CCCCC(CC)COc1nc(-c2ccc3c(c2)-c2cc4ccccc4cc2C3(c2ccccc2)c2ccccc2)nc(-c2ccccc2O)n1.CCCCC(CC)COc1nc(-c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2ccccc2-3)nc(-c2ccccc2O)n1.CCCCC(CC)COc1nc(-c2ccccc2O)nc(-c2cccc3c2-c2ccccc2C3(c2ccccc2)c2ccccc2)n1.CCCCC(CC)COc1nc(-c2ccccc2O)nc(-c2cccc3c2C(c2ccccc2)(c2ccccc2)c2ccccc2-3)n1.
What is the InChIKey of 2-[4-(11,11-diphenylbenzo[b]fluoren-3-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-1-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-4-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(2-ethylhexoxy)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazin-2-yl]phenol?
The InChIKey is BVNDQVCFCITOFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H41N3O2.C42H37N3O2.2C42H39N3O2/c1-3-5-16-31(4-2)30-51-45-48-43(47-44(49-45)37-23-14-15-24-42(37)50)34-25-26-40-38(28-34)39-27-32-17-12-13-18-33(32)29-41(39)46(40,35-19-8-6-9-20-35)36-21-10-7-11-22-36;1-3-5-14-27(4-2)26-47-41-44-39(43-40(45-41)33-18-9-13-22-38(33)46)28-23-24-32-31-17-8-12-21-36(31)42(37(32)25-28)34-19-10-6-15-29(34)30-16-7-11-20-35(30)42;1-3-5-17-29(4-2)28-47-41-44-39(34-23-13-15-27-37(34)46)43-40(45-41)35-25-16-24-33-32-22-12-14-26-36(32)42(38(33)35,30-18-8-6-9-19-30)31-20-10-7-11-21-31;1-3-5-17-29(4-2)28-47-41-44-39(33-23-13-15-27-37(33)46)43-40(45-41)34-24-16-26-36-38(34)32-22-12-14-25-35(32)42(36,30-18-8-6-9-19-30)31-20-10-7-11-21-31/h6-15,17-29,31,50H,3-5,16,30H2,1-2H3;6-13,15-25,27,46H,3-5,14,26H2,1-2H3;2*6-16,18-27,29,46H,3-5,17,28H2,1-2H3.
What are the key properties of 2-[4-(11,11-diphenylbenzo[b]fluoren-3-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-1-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-4-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(2-ethylhexoxy)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazin-2-yl]phenol?
2-[4-(11,11-diphenylbenzo[b]fluoren-3-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-1-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-4-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(2-ethylhexoxy)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazin-2-yl]phenol has a molecular weight of 2519.22 g/mol, XLogP of 40.61, 42 rotatable bonds, 4 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(11,11-diphenylbenzo[b]fluoren-3-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-1-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(9,9-diphenylfluoren-4-yl)-6-(2-ethylhexoxy)-1,3,5-triazin-2-yl]phenol;2-[4-(2-ethylhexoxy)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazin-2-yl]phenol is sourced from PubChem (CID 164961041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).