N-naphthalen-1-yl-8-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-[3-(8-phenyldibenzothiophen-2-yl)phenyl]phenyl]naphthalen-1-amine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-(N-(6-phenyldibenzofuran-3-yl)anilino)phenyl]benzene-1,3-diamine

C168H114N6O2S — CID 158069740

IUPACN-naphthalen-1-yl-8-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-[3-(8-phenyldibenzothiophen-2-yl)phenyl]phenyl]naphthalen-1-amine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-(N-(6-phenyldibenzofuran-3-yl)anilino)phenyl]benzene-1,3-diamine
SMILESc1ccc(-c2ccc3oc4ccc(N(c5ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)cc5)c5cccc6ccccc56)cc4c3c2)cc1.c1ccc(-c2ccc3sc4ccc(-c5cccc(-c6ccc(N(c7ccc(-c8cccc9ccccc89)cc7)c7cccc8ccccc78)cc6)c5)cc4c3c2)cc1.c1ccc(-c2cccc3c2oc2cc(N(c4ccccc4)c4ccc(-c5cc(N(c6ccccc6)c6ccccc6)cc(N(c6ccccc6)c6ccccc6)c5)cc4)ccc23)cc1
InChIInChI=1S/C60H43N3O.C56H37NS.C52H34N2O/c1-7-20-45(21-8-1)56-32-19-33-58-57-39-38-53(43-59(57)64-60(56)58)61(47-22-9-2-10-23-47)52-36-34-44(35-37-52)46-40-54(62(48-24-11-3-12-25-48)49-26-13-4-14-27-49)42-55(41-46)63(50-28-15-5-16-29-50)51-30-17-6-18-31-51;1-2-11-38(12-3-1)45-27-33-55-52(36-45)53-37-46(28-34-56(53)58-55)44-18-8-17-43(35-44)39-23-29-47(30-24-39)57(54-22-10-16-41-14-5-7-20-51(41)54)48-31-25-42(26-32-48)50-21-9-15-40-13-4-6-19-49(40)50;1-3-12-35(13-4-1)39-25-30-51-46(33-39)47-34-42(28-31-52(47)55-51)53(48-21-11-15-37-14-7-8-18-43(37)48)41-26-22-36(23-27-41)38-24-29-50-45(32-38)44-19-9-10-20-49(44)54(50)40-16-5-2-6-17-40/h1-43H;1-37H;1-34H
InChIKeyFLRIWAPHRLFMMQ-UHFFFAOYSA-N
MW2280.87 g/mol
LogP48.47
Rot. Bonds24

About N-naphthalen-1-yl-8-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-[3-(8-phenyldibenzothiophen-2-yl)phenyl]phenyl]naphthalen-1-amine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-(N-(6-phenyldibenzofuran-3-yl)anilino)phenyl]benzene-1,3-diamine

N-naphthalen-1-yl-8-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-[3-(8-phenyldibenzothiophen-2-yl)phenyl]phenyl]naphthalen-1-amine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-(N-(6-phenyldibenzofuran-3-yl)anilino)phenyl]benzene-1,3-diamine (PubChem CID 158069740) has the molecular formula C168H114N6O2S and a molecular weight of 2280.87 g/mol. Its IUPAC name is N-naphthalen-1-yl-8-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-[3-(8-phenyldibenzothiophen-2-yl)phenyl]phenyl]naphthalen-1-amine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-(N-(6-phenyldibenzofuran-3-yl)anilino)phenyl]benzene-1,3-diamine.

Molecular Properties

Compound NameN-naphthalen-1-yl-8-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-[3-(8-phenyldibenzothiophen-2-yl)phenyl]phenyl]naphthalen-1-amine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-(N-(6-phenyldibenzofuran-3-yl)anilino)phenyl]benzene-1,3-diamine
PubChem CID158069740
Molecular FormulaC168H114N6O2S
Molecular Weight2280.87 g/mol
Exact Mass2278.87
IUPAC NameN-naphthalen-1-yl-8-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-[3-(8-phenyldibenzothiophen-2-yl)phenyl]phenyl]naphthalen-1-amine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-(N-(6-phenyldibenzofuran-3-yl)anilino)phenyl]benzene-1,3-diamine
SMILESc1ccc(-c2ccc3oc4ccc(N(c5ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)cc5)c5cccc6ccccc56)cc4c3c2)cc1.c1ccc(-c2ccc3sc4ccc(-c5cccc(-c6ccc(N(c7ccc(-c8cccc9ccccc89)cc7)c7cccc8ccccc78)cc6)c5)cc4c3c2)cc1.c1ccc(-c2cccc3c2oc2cc(N(c4ccccc4)c4ccc(-c5cc(N(c6ccccc6)c6ccccc6)cc(N(c6ccccc6)c6ccccc6)c5)cc4)ccc23)cc1
InChIInChI=1S/C60H43N3O.C56H37NS.C52H34N2O/c1-7-20-45(21-8-1)56-32-19-33-58-57-39-38-53(43-59(57)64-60(56)58)61(47-22-9-2-10-23-47)52-36-34-44(35-37-52)46-40-54(62(48-24-11-3-12-25-48)49-26-13-4-14-27-49)42-55(41-46)63(50-28-15-5-16-29-50)51-30-17-6-18-31-51;1-2-11-38(12-3-1)45-27-33-55-52(36-45)53-37-46(28-34-56(53)58-55)44-18-8-17-43(35-44)39-23-29-47(30-24-39)57(54-22-10-16-41-14-5-7-20-51(41)54)48-31-25-42(26-32-48)50-21-9-15-40-13-4-6-19-49(40)50;1-3-12-35(13-4-1)39-25-30-51-46(33-39)47-34-42(28-31-52(47)55-51)53(48-21-11-15-37-14-7-8-18-43(37)48)41-26-22-36(23-27-41)38-24-29-50-45(32-38)44-19-9-10-20-49(44)54(50)40-16-5-2-6-17-40/h1-43H;1-37H;1-34H
InChIKeyFLRIWAPHRLFMMQ-UHFFFAOYSA-N
XLogP48.47
TPSA47.41 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds24
Heavy Atoms177
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002280.87
LogP ≤ 548.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze N-naphthalen-1-yl-8-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-[3-(8-phenyldibenzothiophen-2-yl)phenyl]phenyl]naphthalen-1-amine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-(N-(6-phenyldibenzofuran-3-yl)anilino)phenyl]benzene-1,3-diamine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-naphthalen-1-yl-8-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-[3-(8-phenyldibenzothiophen-2-yl)phenyl]phenyl]naphthalen-1-amine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-(N-(6-phenyldibenzofuran-3-yl)anilino)phenyl]benzene-1,3-diamine?
The IUPAC name of N-naphthalen-1-yl-8-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-[3-(8-phenyldibenzothiophen-2-yl)phenyl]phenyl]naphthalen-1-amine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-(N-(6-phenyldibenzofuran-3-yl)anilino)phenyl]benzene-1,3-diamine (CID 158069740) is N-naphthalen-1-yl-8-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-[3-(8-phenyldibenzothiophen-2-yl)phenyl]phenyl]naphthalen-1-amine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-(N-(6-phenyldibenzofuran-3-yl)anilino)phenyl]benzene-1,3-diamine.
What is the SMILES notation for N-naphthalen-1-yl-8-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-[3-(8-phenyldibenzothiophen-2-yl)phenyl]phenyl]naphthalen-1-amine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-(N-(6-phenyldibenzofuran-3-yl)anilino)phenyl]benzene-1,3-diamine?
The canonical SMILES for N-naphthalen-1-yl-8-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-[3-(8-phenyldibenzothiophen-2-yl)phenyl]phenyl]naphthalen-1-amine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-(N-(6-phenyldibenzofuran-3-yl)anilino)phenyl]benzene-1,3-diamine is c1ccc(-c2ccc3oc4ccc(N(c5ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)cc5)c5cccc6ccccc56)cc4c3c2)cc1.c1ccc(-c2ccc3sc4ccc(-c5cccc(-c6ccc(N(c7ccc(-c8cccc9ccccc89)cc7)c7cccc8ccccc78)cc6)c5)cc4c3c2)cc1.c1ccc(-c2cccc3c2oc2cc(N(c4ccccc4)c4ccc(-c5cc(N(c6ccccc6)c6ccccc6)cc(N(c6ccccc6)c6ccccc6)c5)cc4)ccc23)cc1.
What is the InChIKey of N-naphthalen-1-yl-8-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-[3-(8-phenyldibenzothiophen-2-yl)phenyl]phenyl]naphthalen-1-amine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-(N-(6-phenyldibenzofuran-3-yl)anilino)phenyl]benzene-1,3-diamine?
The InChIKey is FLRIWAPHRLFMMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H43N3O.C56H37NS.C52H34N2O/c1-7-20-45(21-8-1)56-32-19-33-58-57-39-38-53(43-59(57)64-60(56)58)61(47-22-9-2-10-23-47)52-36-34-44(35-37-52)46-40-54(62(48-24-11-3-12-25-48)49-26-13-4-14-27-49)42-55(41-46)63(50-28-15-5-16-29-50)51-30-17-6-18-31-51;1-2-11-38(12-3-1)45-27-33-55-52(36-45)53-37-46(28-34-56(53)58-55)44-18-8-17-43(35-44)39-23-29-47(30-24-39)57(54-22-10-16-41-14-5-7-20-51(41)54)48-31-25-42(26-32-48)50-21-9-15-40-13-4-6-19-49(40)50;1-3-12-35(13-4-1)39-25-30-51-46(33-39)47-34-42(28-31-52(47)55-51)53(48-21-11-15-37-14-7-8-18-43(37)48)41-26-22-36(23-27-41)38-24-29-50-45(32-38)44-19-9-10-20-49(44)54(50)40-16-5-2-6-17-40/h1-43H;1-37H;1-34H.
What are the key properties of N-naphthalen-1-yl-8-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-[3-(8-phenyldibenzothiophen-2-yl)phenyl]phenyl]naphthalen-1-amine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-(N-(6-phenyldibenzofuran-3-yl)anilino)phenyl]benzene-1,3-diamine?
N-naphthalen-1-yl-8-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-[3-(8-phenyldibenzothiophen-2-yl)phenyl]phenyl]naphthalen-1-amine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-(N-(6-phenyldibenzofuran-3-yl)anilino)phenyl]benzene-1,3-diamine has a molecular weight of 2280.87 g/mol, XLogP of 48.47, 24 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-1-yl-8-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-[3-(8-phenyldibenzothiophen-2-yl)phenyl]phenyl]naphthalen-1-amine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-(N-(6-phenyldibenzofuran-3-yl)anilino)phenyl]benzene-1,3-diamine is sourced from PubChem (CID 158069740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).