N-dibenzofuran-1-yl-N-dibenzofuran-2-yl-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzofuran-2-yl-N-dibenzothiophen-3-yl-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-naphtho[2,3-b][1]benzofuran-3-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine

C187H114N8O9S — CID 157145953

About N-dibenzofuran-1-yl-N-dibenzofuran-2-yl-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzofuran-2-yl-N-dibenzothiophen-3-yl-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-naphtho[2,3-b][1]benzofuran-3-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine

N-dibenzofuran-1-yl-N-dibenzofuran-2-yl-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzofuran-2-yl-N-dibenzothiophen-3-yl-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-naphtho[2,3-b][1]benzofuran-3-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine (PubChem CID 157145953) has the molecular formula C187H114N8O9S and a molecular weight of 2649.08 g/mol. Its IUPAC name is N-dibenzofuran-1-yl-N-dibenzofuran-2-yl-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzofuran-2-yl-N-dibenzothiophen-3-yl-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-naphtho[2,3-b][1]benzofuran-3-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine.

Molecular Properties

• Compound Name: N-dibenzofuran-1-yl-N-dibenzofuran-2-yl-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzofuran-2-yl-N-dibenzothiophen-3-yl-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-naphtho[2,3-b][1]benzofuran-3-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine
• PubChem CID: 157145953
• Molecular Formula: C187H114N8O9S
• Molecular Weight: 2649.08 g/mol
• Exact Mass: 2646.84
• IUPAC Name: N-dibenzofuran-1-yl-N-dibenzofuran-2-yl-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzofuran-2-yl-N-dibenzothiophen-3-yl-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-naphtho[2,3-b][1]benzofuran-3-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine
• SMILES: CC1(C)c2ccccc2-c2ccc(N(c3ccc4oc5ccccc5c4c3)c3ccc4ccc5ccc6nc(-c7ccccc7)oc6c5c4c3)cc21.c1ccc(-c2ccc(N(c3ccc4c(c3)oc3cc5ccccc5cc34)c3ccc4ccc5ccc6nc(-c7ccccc7)oc6c5c4c3)cc2)cc1.c1ccc(-c2nc3ccc4ccc5ccc(N(c6ccc7c(c6)sc6ccccc67)c6ccc7oc8ccccc8c7c6)cc5c4c3o2)cc1.c1ccc(-c2nc3ccc4ccc5ccc(N(c6ccc7oc8ccccc8c7c6)c6cccc7oc8ccccc8c67)cc5c4c3o2)cc1
• InChI: InChI=1S/C49H30N2O2.C48H32N2O2.C45H26N2O3.C45H26N2O2S/c1-3-9-31(10-4-1)32-17-21-38(22-18-32)51(40-24-25-41-43-27-36-13-7-8-14-37(36)28-45(43)52-46(41)30-40)39-23-19-33-15-16-34-20-26-44-48(47(34)42(33)29-39)53-49(50-44)35-11-5-2-6-12-35;1-48(2)40-14-8-6-12-35(40)36-23-21-34(28-41(36)48)50(33-22-25-44-39(27-33)37-13-7-9-15-43(37)51-44)32-20-18-29-16-17-30-19-24-42-46(45(30)38(29)26-32)52-47(49-42)31-10-4-3-5-11-31;1-2-9-29(10-3-1)45-46-36-23-20-28-18-17-27-19-21-30(25-34(27)42(28)44(36)50-45)47(31-22-24-40-35(26-31)32-11-4-6-14-38(32)48-40)37-13-8-16-41-43(37)33-12-5-7-15-39(33)49-41;1-2-8-29(9-3-1)45-46-38-22-17-28-15-14-27-16-18-30(24-36(27)43(28)44(38)49-45)47(31-20-23-40-37(25-31)33-10-4-6-12-39(33)48-40)32-19-21-35-34-11-5-7-13-41(34)50-42(35)26-32/h1-30H;3-28H,1-2H3;2*1-26H
• InChIKey: AKRXWAPMLZADDE-UHFFFAOYSA-N
• XLogP: 54.08
• TPSA: 182.78 Ų
• H-Bond Acceptors: 18
• Rotatable Bonds: 17
• Heavy Atoms: 205
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2649.08
LogP ≤ 5	54.08
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	18

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-dibenzofuran-1-yl-N-dibenzofuran-2-yl-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzofuran-2-yl-N-dibenzothiophen-3-yl-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-naphtho[2,3-b][1]benzofuran-3-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine?

The IUPAC name of N-dibenzofuran-1-yl-N-dibenzofuran-2-yl-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzofuran-2-yl-N-dibenzothiophen-3-yl-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-naphtho[2,3-b][1]benzofuran-3-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine (CID 157145953) is N-dibenzofuran-1-yl-N-dibenzofuran-2-yl-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzofuran-2-yl-N-dibenzothiophen-3-yl-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-naphtho[2,3-b][1]benzofuran-3-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine.

What is the SMILES notation for N-dibenzofuran-1-yl-N-dibenzofuran-2-yl-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzofuran-2-yl-N-dibenzothiophen-3-yl-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-naphtho[2,3-b][1]benzofuran-3-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine?

The canonical SMILES for N-dibenzofuran-1-yl-N-dibenzofuran-2-yl-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzofuran-2-yl-N-dibenzothiophen-3-yl-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-naphtho[2,3-b][1]benzofuran-3-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine is CC1(C)c2ccccc2-c2ccc(N(c3ccc4oc5ccccc5c4c3)c3ccc4ccc5ccc6nc(-c7ccccc7)oc6c5c4c3)cc21.c1ccc(-c2ccc(N(c3ccc4c(c3)oc3cc5ccccc5cc34)c3ccc4ccc5ccc6nc(-c7ccccc7)oc6c5c4c3)cc2)cc1.c1ccc(-c2nc3ccc4ccc5ccc(N(c6ccc7c(c6)sc6ccccc67)c6ccc7oc8ccccc8c7c6)cc5c4c3o2)cc1.c1ccc(-c2nc3ccc4ccc5ccc(N(c6ccc7oc8ccccc8c7c6)c6cccc7oc8ccccc8c67)cc5c4c3o2)cc1.

What is the InChIKey of N-dibenzofuran-1-yl-N-dibenzofuran-2-yl-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzofuran-2-yl-N-dibenzothiophen-3-yl-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-naphtho[2,3-b][1]benzofuran-3-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine?

The InChIKey is AKRXWAPMLZADDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C49H30N2O2.C48H32N2O2.C45H26N2O3.C45H26N2O2S/c1-3-9-31(10-4-1)32-17-21-38(22-18-32)51(40-24-25-41-43-27-36-13-7-8-14-37(36)28-45(43)52-46(41)30-40)39-23-19-33-15-16-34-20-26-44-48(47(34)42(33)29-39)53-49(50-44)35-11-5-2-6-12-35;1-48(2)40-14-8-6-12-35(40)36-23-21-34(28-41(36)48)50(33-22-25-44-39(27-33)37-13-7-9-15-43(37)51-44)32-20-18-29-16-17-30-19-24-42-46(45(30)38(29)26-32)52-47(49-42)31-10-4-3-5-11-31;1-2-9-29(10-3-1)45-46-36-23-20-28-18-17-27-19-21-30(25-34(27)42(28)44(36)50-45)47(31-22-24-40-35(26-31)32-11-4-6-14-38(32)48-40)37-13-8-16-41-43(37)33-12-5-7-15-39(33)49-41;1-2-8-29(9-3-1)45-46-38-22-17-28-15-14-27-16-18-30(24-36(27)43(28)44(38)49-45)47(31-20-23-40-37(25-31)33-10-4-6-12-39(33)48-40)32-19-21-35-34-11-5-7-13-41(34)50-42(35)26-32/h1-30H;3-28H,1-2H3;2*1-26H.

What are the key properties of N-dibenzofuran-1-yl-N-dibenzofuran-2-yl-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzofuran-2-yl-N-dibenzothiophen-3-yl-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-naphtho[2,3-b][1]benzofuran-3-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine?

N-dibenzofuran-1-yl-N-dibenzofuran-2-yl-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzofuran-2-yl-N-dibenzothiophen-3-yl-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-naphtho[2,3-b][1]benzofuran-3-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine has a molecular weight of 2649.08 g/mol, XLogP of 54.08, 17 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for N-dibenzofuran-1-yl-N-dibenzofuran-2-yl-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzofuran-2-yl-N-dibenzothiophen-3-yl-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-2-yl)-2-phenylnaphtho[2,1-g][1,3]benzoxazol-10-amine;N-naphtho[2,3-b][1]benzofuran-3-yl-2-phenyl-N-(4-phenylphenyl)naphtho[2,1-g][1,3]benzoxazol-10-amine is sourced from PubChem (CID 157145953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).