10-[3-(11,11-diphenylbenzo[a]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(7,7-diphenylbenzo[g]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(9,9-diphenylfluoren-2-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole

C164H103N3O3 — CID 159418356

IUPAC10-[3-(11,11-diphenylbenzo[a]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(7,7-diphenylbenzo[g]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(9,9-diphenylfluoren-2-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole
SMILESc1ccc(-c2nc3ccc4ccc5ccc(-c6cccc(-c7ccc8c(c7)C(c7ccccc7)(c7ccccc7)c7c-8ccc8ccccc78)c6)cc5c4c3o2)cc1.c1ccc(-c2nc3ccc4ccc5ccc(-c6cccc(-c7ccc8c(c7)C(c7ccccc7)(c7ccccc7)c7ccc9ccccc9c7-8)c6)cc5c4c3o2)cc1.c1ccc(-c2nc3ccc4ccc5ccc(-c6cccc(-c7ccc8c(c7)C(c7ccccc7)(c7ccccc7)c7ccccc7-8)c6)cc5c4c3o2)cc1
InChIInChI=1S/2C56H35NO.C52H33NO/c1-4-14-39(15-5-1)55-57-51-32-29-38-25-23-37-24-26-42(34-49(37)52(38)54(51)58-55)40-16-12-17-41(33-40)43-28-30-47-48-31-27-36-13-10-11-22-46(36)53(48)56(50(47)35-43,44-18-6-2-7-19-44)45-20-8-3-9-21-45;1-4-14-39(15-5-1)55-57-51-32-29-38-25-23-37-24-26-42(34-48(37)52(38)54(51)58-55)40-16-12-17-41(33-40)43-27-30-47-50(35-43)56(44-18-6-2-7-19-44,45-20-8-3-9-21-45)49-31-28-36-13-10-11-22-46(36)53(47)49;1-4-13-36(14-5-1)51-53-48-30-28-35-25-23-34-24-26-39(32-45(34)49(35)50(48)54-51)37-15-12-16-38(31-37)40-27-29-44-43-21-10-11-22-46(43)52(47(44)33-40,41-17-6-2-7-18-41)42-19-8-3-9-20-42/h2*1-35H;1-33H
InChIKeyLPLJOMXKMIIUDV-UHFFFAOYSA-N
MW2163.65 g/mol
LogP42.80
Rot. Bonds15

About 10-[3-(11,11-diphenylbenzo[a]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(7,7-diphenylbenzo[g]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(9,9-diphenylfluoren-2-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole

10-[3-(11,11-diphenylbenzo[a]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(7,7-diphenylbenzo[g]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(9,9-diphenylfluoren-2-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole (PubChem CID 159418356) has the molecular formula C164H103N3O3 and a molecular weight of 2163.65 g/mol. Its IUPAC name is 10-[3-(11,11-diphenylbenzo[a]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(7,7-diphenylbenzo[g]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(9,9-diphenylfluoren-2-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole.

Molecular Properties

Compound Name10-[3-(11,11-diphenylbenzo[a]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(7,7-diphenylbenzo[g]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(9,9-diphenylfluoren-2-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole
PubChem CID159418356
Molecular FormulaC164H103N3O3
Molecular Weight2163.65 g/mol
Exact Mass2161.80
IUPAC Name10-[3-(11,11-diphenylbenzo[a]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(7,7-diphenylbenzo[g]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(9,9-diphenylfluoren-2-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole
SMILESc1ccc(-c2nc3ccc4ccc5ccc(-c6cccc(-c7ccc8c(c7)C(c7ccccc7)(c7ccccc7)c7c-8ccc8ccccc78)c6)cc5c4c3o2)cc1.c1ccc(-c2nc3ccc4ccc5ccc(-c6cccc(-c7ccc8c(c7)C(c7ccccc7)(c7ccccc7)c7ccc9ccccc9c7-8)c6)cc5c4c3o2)cc1.c1ccc(-c2nc3ccc4ccc5ccc(-c6cccc(-c7ccc8c(c7)C(c7ccccc7)(c7ccccc7)c7ccccc7-8)c6)cc5c4c3o2)cc1
InChIInChI=1S/2C56H35NO.C52H33NO/c1-4-14-39(15-5-1)55-57-51-32-29-38-25-23-37-24-26-42(34-49(37)52(38)54(51)58-55)40-16-12-17-41(33-40)43-28-30-47-48-31-27-36-13-10-11-22-46(36)53(48)56(50(47)35-43,44-18-6-2-7-19-44)45-20-8-3-9-21-45;1-4-14-39(15-5-1)55-57-51-32-29-38-25-23-37-24-26-42(34-48(37)52(38)54(51)58-55)40-16-12-17-41(33-40)43-27-30-47-50(35-43)56(44-18-6-2-7-19-44,45-20-8-3-9-21-45)49-31-28-36-13-10-11-22-46(36)53(47)49;1-4-13-36(14-5-1)51-53-48-30-28-35-25-23-34-24-26-39(32-45(34)49(35)50(48)54-51)37-15-12-16-38(31-37)40-27-29-44-43-21-10-11-22-46(43)52(47(44)33-40,41-17-6-2-7-18-41)42-19-8-3-9-20-42/h2*1-35H;1-33H
InChIKeyLPLJOMXKMIIUDV-UHFFFAOYSA-N
XLogP42.80
TPSA78.09 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds15
Heavy Atoms170
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002163.65
LogP ≤ 542.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 10-[3-(11,11-diphenylbenzo[a]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(7,7-diphenylbenzo[g]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(9,9-diphenylfluoren-2-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole with MolForge

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Related Compounds

9-(11,11-diphenylbenzo[a]fluoren-9-yl)-2-phenylnaphtho[2,1-g][1,3]benzoxazole;2-phenyl-9-spiro[benzo[a]fluorene-11,9'-fluorene]-9-ylnaphtho[2,1-g][1,3]benzoxazole;2-phenyl-9-spiro[benzo[b]fluorene-11,9'-fluorene]-2-ylnaphtho[2,1-g][1,3]benzoxazole
CID 163997775
10-[3-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole
CID 147893575
2-[4-[3-[4-(1,3-benzoxazol-2-yl)phenyl]-5-(11,11-diphenylbenzo[a]fluoren-9-yl)phenyl]phenyl]-1,3-benzoxazole
CID 164803969
10-(3-benzo[c]phenanthren-5-ylphenyl)-2-phenylnaphtho[2,1-g][1,3]benzoxazole
CID 146330210
2-[3-(1,3-benzoxazol-2-yl)-5-[3-(11,11-diphenylbenzo[a]fluoren-9-yl)phenyl]phenyl]-1,3-benzoxazole
CID 164803928
2-phenyl-10-[2-(2-phenylphenyl)phenyl]naphtho[2,1-g][1,3]benzoxazole;2-phenyl-10-[3-(3-phenylphenyl)phenyl]naphtho[2,1-g][1,3]benzoxazole;2-phenyl-10-[4-(3-phenylphenyl)phenyl]naphtho[2,1-g][1,3]benzoxazole;2-phenyl-10-[4-(4-phenylphenyl)phenyl]naphtho[2,1-g][1,3]benzoxazole
CID 161086065
2-phenyl-10-[10-(3-phenylphenyl)anthracen-9-yl]naphtho[2,1-g][1,3]benzoxazole
CID 164758486
2-phenyl-4-[4-(7-phenylbenzo[c]fluoren-7-yl)phenyl]-6-(3-phenylphenyl)-1,3,5-triazine
CID 134487429
2,4-diphenyl-6-[4-[4-(7-phenylbenzo[c]fluoren-7-yl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4-[4-[4-(7-phenylbenzo[c]fluoren-7-yl)phenyl]phenyl]-6-(4-phenylphenyl)-1,3,5-triazine;2-phenyl-4-[4-(7-phenylbenzo[c]fluoren-7-yl)phenyl]-6-[3-(4-phenylphenyl)phenyl]-1,3,5-triazine;2-phenyl-4-[4-(7-phenylbenzo[c]fluoren-7-yl)phenyl]-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazine
CID 158764717
2,4-bis(3-phenylphenyl)-6-spiro[benzo[c]fluorene-7,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-11'-yl-1,3,5-triazine
CID 134574249
1-[3-(9,9-diphenylfluoren-2-yl)phenyl]-6-(3-naphthalen-1-ylphenyl)pyrene
CID 170778639
2-[3-(1,3-benzoxazol-2-yl)-5-[3-(7,7-diphenylbenzo[c]fluoren-10-yl)phenyl]phenyl]-1,3-benzoxazole
CID 164803933

Frequently Asked Questions

What is the IUPAC name of 10-[3-(11,11-diphenylbenzo[a]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(7,7-diphenylbenzo[g]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(9,9-diphenylfluoren-2-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole?
The IUPAC name of 10-[3-(11,11-diphenylbenzo[a]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(7,7-diphenylbenzo[g]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(9,9-diphenylfluoren-2-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole (CID 159418356) is 10-[3-(11,11-diphenylbenzo[a]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(7,7-diphenylbenzo[g]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(9,9-diphenylfluoren-2-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole.
What is the SMILES notation for 10-[3-(11,11-diphenylbenzo[a]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(7,7-diphenylbenzo[g]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(9,9-diphenylfluoren-2-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole?
The canonical SMILES for 10-[3-(11,11-diphenylbenzo[a]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(7,7-diphenylbenzo[g]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(9,9-diphenylfluoren-2-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole is c1ccc(-c2nc3ccc4ccc5ccc(-c6cccc(-c7ccc8c(c7)C(c7ccccc7)(c7ccccc7)c7c-8ccc8ccccc78)c6)cc5c4c3o2)cc1.c1ccc(-c2nc3ccc4ccc5ccc(-c6cccc(-c7ccc8c(c7)C(c7ccccc7)(c7ccccc7)c7ccc9ccccc9c7-8)c6)cc5c4c3o2)cc1.c1ccc(-c2nc3ccc4ccc5ccc(-c6cccc(-c7ccc8c(c7)C(c7ccccc7)(c7ccccc7)c7ccccc7-8)c6)cc5c4c3o2)cc1.
What is the InChIKey of 10-[3-(11,11-diphenylbenzo[a]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(7,7-diphenylbenzo[g]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(9,9-diphenylfluoren-2-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole?
The InChIKey is LPLJOMXKMIIUDV-UHFFFAOYSA-N. The full InChI is InChI=1S/2C56H35NO.C52H33NO/c1-4-14-39(15-5-1)55-57-51-32-29-38-25-23-37-24-26-42(34-49(37)52(38)54(51)58-55)40-16-12-17-41(33-40)43-28-30-47-48-31-27-36-13-10-11-22-46(36)53(48)56(50(47)35-43,44-18-6-2-7-19-44)45-20-8-3-9-21-45;1-4-14-39(15-5-1)55-57-51-32-29-38-25-23-37-24-26-42(34-48(37)52(38)54(51)58-55)40-16-12-17-41(33-40)43-27-30-47-50(35-43)56(44-18-6-2-7-19-44,45-20-8-3-9-21-45)49-31-28-36-13-10-11-22-46(36)53(47)49;1-4-13-36(14-5-1)51-53-48-30-28-35-25-23-34-24-26-39(32-45(34)49(35)50(48)54-51)37-15-12-16-38(31-37)40-27-29-44-43-21-10-11-22-46(43)52(47(44)33-40,41-17-6-2-7-18-41)42-19-8-3-9-20-42/h2*1-35H;1-33H.
What are the key properties of 10-[3-(11,11-diphenylbenzo[a]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(7,7-diphenylbenzo[g]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(9,9-diphenylfluoren-2-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole?
10-[3-(11,11-diphenylbenzo[a]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(7,7-diphenylbenzo[g]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(9,9-diphenylfluoren-2-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole has a molecular weight of 2163.65 g/mol, XLogP of 42.80, 15 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[3-(11,11-diphenylbenzo[a]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(7,7-diphenylbenzo[g]fluoren-9-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole;10-[3-(9,9-diphenylfluoren-2-yl)phenyl]-2-phenylnaphtho[2,1-g][1,3]benzoxazole is sourced from PubChem (CID 159418356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).