4-N-dibenzofuran-4-yl-4-N,17-N-diphenyl-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N-dibenzofuran-4-yl-17-N-phenyl-4-N-(2-phenylphenyl)-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N-naphthalen-2-yl-4-N,17-N-diphenyl-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine

C175H130N6O5Si3 — CID 159690787

About 4-N-dibenzofuran-4-yl-4-N,17-N-diphenyl-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N-dibenzofuran-4-yl-17-N-phenyl-4-N-(2-phenylphenyl)-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N-naphthalen-2-yl-4-N,17-N-diphenyl-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine

4-N-dibenzofuran-4-yl-4-N,17-N-diphenyl-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N-dibenzofuran-4-yl-17-N-phenyl-4-N-(2-phenylphenyl)-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N-naphthalen-2-yl-4-N,17-N-diphenyl-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine (PubChem CID 159690787) has the molecular formula C175H130N6O5Si3 and a molecular weight of 2481.26 g/mol. Its IUPAC name is 4-N-dibenzofuran-4-yl-4-N,17-N-diphenyl-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N-dibenzofuran-4-yl-17-N-phenyl-4-N-(2-phenylphenyl)-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N-naphthalen-2-yl-4-N,17-N-diphenyl-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine.

Molecular Properties

• Compound Name: 4-N-dibenzofuran-4-yl-4-N,17-N-diphenyl-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N-dibenzofuran-4-yl-17-N-phenyl-4-N-(2-phenylphenyl)-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N-naphthalen-2-yl-4-N,17-N-diphenyl-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine
• PubChem CID: 159690787
• Molecular Formula: C175H130N6O5Si3
• Molecular Weight: 2481.26 g/mol
• Exact Mass: 2478.94
• IUPAC Name: 4-N-dibenzofuran-4-yl-4-N,17-N-diphenyl-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N-dibenzofuran-4-yl-17-N-phenyl-4-N-(2-phenylphenyl)-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N-naphthalen-2-yl-4-N,17-N-diphenyl-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine
• SMILES: C[Si](C)(C)c1ccc(N(c2ccccc2)c2ccc3c(c2)Oc2cccc4c2c-3cc2c3ccccc3c(N(c3ccccc3)c3ccc5ccccc5c3)cc42)cc1.C[Si](C)(C)c1ccc(N(c2ccccc2)c2ccc3c(c2)Oc2cccc4c2c-3cc2c3ccccc3c(N(c3ccccc3)c3cccc5c3oc3ccccc35)cc42)cc1.C[Si](C)(C)c1ccc(N(c2ccccc2)c2ccc3c(c2)Oc2cccc4c2c-3cc2c3ccccc3c(N(c3ccccc3-c3ccccc3)c3cccc5c3oc3ccccc35)cc42)cc1
• InChI: InChI=1S/C63H46N2O2Si.C57H42N2O2Si.C55H42N2OSi/c1-68(2,3)45-35-32-43(33-36-45)64(42-20-8-5-9-21-42)44-34-37-50-55-39-53-47-23-10-11-24-48(47)58(40-54(53)51-26-17-31-60(62(51)55)66-61(50)38-44)65(56-28-14-12-22-46(56)41-18-6-4-7-19-41)57-29-16-27-52-49-25-13-15-30-59(49)67-63(52)57;1-62(2,3)41-31-28-39(29-32-41)58(37-16-6-4-7-17-37)40-30-33-45-50-35-48-42-20-10-11-21-43(42)52(36-49(48)46-23-15-27-54(56(46)50)60-55(45)34-40)59(38-18-8-5-9-19-38)51-25-14-24-47-44-22-12-13-26-53(44)61-57(47)51;1-59(2,3)44-30-27-41(28-31-44)56(39-17-6-4-7-18-39)43-29-32-47-51-35-49-45-21-12-13-22-46(45)52(36-50(49)48-23-14-24-53(55(48)51)58-54(47)34-43)57(40-19-8-5-9-20-40)42-26-25-37-15-10-11-16-38(37)33-42/h4-40H,1-3H3;4-36H,1-3H3;4-36H,1-3H3
• InChIKey: MWJPKISKKSRVPN-UHFFFAOYSA-N
• XLogP: 49.83
• TPSA: 73.41 Ų
• H-Bond Acceptors: 11
• Rotatable Bonds: 22
• Heavy Atoms: 189
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2481.26
LogP ≤ 5	49.83
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	11

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-N-dibenzofuran-4-yl-4-N,17-N-diphenyl-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N-dibenzofuran-4-yl-17-N-phenyl-4-N-(2-phenylphenyl)-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N-naphthalen-2-yl-4-N,17-N-diphenyl-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine?

The IUPAC name of 4-N-dibenzofuran-4-yl-4-N,17-N-diphenyl-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N-dibenzofuran-4-yl-17-N-phenyl-4-N-(2-phenylphenyl)-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N-naphthalen-2-yl-4-N,17-N-diphenyl-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine (CID 159690787) is 4-N-dibenzofuran-4-yl-4-N,17-N-diphenyl-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N-dibenzofuran-4-yl-17-N-phenyl-4-N-(2-phenylphenyl)-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N-naphthalen-2-yl-4-N,17-N-diphenyl-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine.

What is the SMILES notation for 4-N-dibenzofuran-4-yl-4-N,17-N-diphenyl-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N-dibenzofuran-4-yl-17-N-phenyl-4-N-(2-phenylphenyl)-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N-naphthalen-2-yl-4-N,17-N-diphenyl-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine?

The canonical SMILES for 4-N-dibenzofuran-4-yl-4-N,17-N-diphenyl-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N-dibenzofuran-4-yl-17-N-phenyl-4-N-(2-phenylphenyl)-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N-naphthalen-2-yl-4-N,17-N-diphenyl-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine is C[Si](C)(C)c1ccc(N(c2ccccc2)c2ccc3c(c2)Oc2cccc4c2c-3cc2c3ccccc3c(N(c3ccccc3)c3ccc5ccccc5c3)cc42)cc1.C[Si](C)(C)c1ccc(N(c2ccccc2)c2ccc3c(c2)Oc2cccc4c2c-3cc2c3ccccc3c(N(c3ccccc3)c3cccc5c3oc3ccccc35)cc42)cc1.C[Si](C)(C)c1ccc(N(c2ccccc2)c2ccc3c(c2)Oc2cccc4c2c-3cc2c3ccccc3c(N(c3ccccc3-c3ccccc3)c3cccc5c3oc3ccccc35)cc42)cc1.

What is the InChIKey of 4-N-dibenzofuran-4-yl-4-N,17-N-diphenyl-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N-dibenzofuran-4-yl-17-N-phenyl-4-N-(2-phenylphenyl)-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N-naphthalen-2-yl-4-N,17-N-diphenyl-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine?

The InChIKey is MWJPKISKKSRVPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C63H46N2O2Si.C57H42N2O2Si.C55H42N2OSi/c1-68(2,3)45-35-32-43(33-36-45)64(42-20-8-5-9-21-42)44-34-37-50-55-39-53-47-23-10-11-24-48(47)58(40-54(53)51-26-17-31-60(62(51)55)66-61(50)38-44)65(56-28-14-12-22-46(56)41-18-6-4-7-19-41)57-29-16-27-52-49-25-13-15-30-59(49)67-63(52)57;1-62(2,3)41-31-28-39(29-32-41)58(37-16-6-4-7-17-37)40-30-33-45-50-35-48-42-20-10-11-21-43(42)52(36-49(48)46-23-15-27-54(56(46)50)60-55(45)34-40)59(38-18-8-5-9-19-38)51-25-14-24-47-44-22-12-13-26-53(44)61-57(47)51;1-59(2,3)44-30-27-41(28-31-44)56(39-17-6-4-7-18-39)43-29-32-47-51-35-49-45-21-12-13-22-46(45)52(36-50(49)48-23-14-24-53(55(48)51)58-54(47)34-43)57(40-19-8-5-9-20-40)42-26-25-37-15-10-11-16-38(37)33-42/h4-40H,1-3H3;4-36H,1-3H3;4-36H,1-3H3.

What are the key properties of 4-N-dibenzofuran-4-yl-4-N,17-N-diphenyl-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N-dibenzofuran-4-yl-17-N-phenyl-4-N-(2-phenylphenyl)-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N-naphthalen-2-yl-4-N,17-N-diphenyl-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine?

4-N-dibenzofuran-4-yl-4-N,17-N-diphenyl-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N-dibenzofuran-4-yl-17-N-phenyl-4-N-(2-phenylphenyl)-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N-naphthalen-2-yl-4-N,17-N-diphenyl-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine has a molecular weight of 2481.26 g/mol, XLogP of 49.83, 22 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.

Where does this data come from?

All data for 4-N-dibenzofuran-4-yl-4-N,17-N-diphenyl-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N-dibenzofuran-4-yl-17-N-phenyl-4-N-(2-phenylphenyl)-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N-naphthalen-2-yl-4-N,17-N-diphenyl-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine is sourced from PubChem (CID 159690787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).