4-(1-benzofuran-2-yl)-N-phenylaniline;N-[4-(1-benzofuran-2-yl)phenyl]-6-[7-[6-(N-[4-(1-benzofuran-2-yl)phenyl]anilino)naphthalen-2-yl]-[1]benzofuro[5,6-f][1]benzofuran-2-yl]-N-phenylnaphthalen-2-amine;2,7-bis(6-chloronaphthalen-2-yl)-[1]benzofuro[5,6-f][1]benzofuran

C128H79Cl2N3O7 — CID 160681613

IUPAC4-(1-benzofuran-2-yl)-N-phenylaniline;N-[4-(1-benzofuran-2-yl)phenyl]-6-[7-[6-(N-[4-(1-benzofuran-2-yl)phenyl]anilino)naphthalen-2-yl]-[1]benzofuro[5,6-f][1]benzofuran-2-yl]-N-phenylnaphthalen-2-amine;2,7-bis(6-chloronaphthalen-2-yl)-[1]benzofuro[5,6-f][1]benzofuran
SMILESClc1ccc2cc(-c3cc4cc5cc6cc(-c7ccc8cc(Cl)ccc8c7)oc6cc5cc4o3)ccc2c1.c1ccc(N(c2ccc(-c3cc4ccccc4o3)cc2)c2ccc3cc(-c4cc5cc6cc7cc(-c8ccc9cc(N(c%10ccccc%10)c%10ccc(-c%11cc%12ccccc%12o%11)cc%10)ccc9c8)oc7cc6cc5o4)ccc3c2)cc1.c1ccc(Nc2ccc(-c3cc4ccccc4o3)cc2)cc1
InChIInChI=1S/C74H46N2O4.C34H18Cl2O2.C20H15NO/c1-3-13-61(14-4-1)75(63-29-23-47(24-30-63)69-41-53-11-7-9-17-67(53)77-69)65-33-27-49-35-55(21-19-51(49)39-65)71-45-59-37-57-38-60-46-72(80-74(60)44-58(57)43-73(59)79-71)56-22-20-52-40-66(34-28-50(52)36-56)76(62-15-5-2-6-16-62)64-31-25-48(26-32-64)70-42-54-12-8-10-18-68(54)78-70;35-29-7-5-19-9-23(3-1-21(19)13-29)31-17-27-11-25-12-28-18-32(38-34(28)16-26(25)15-33(27)37-31)24-4-2-22-14-30(36)8-6-20(22)10-24;1-2-7-17(8-3-1)21-18-12-10-15(11-13-18)20-14-16-6-4-5-9-19(16)22-20/h1-46H;1-18H;1-14,21H
InChIKeyROFJBYTWZGRZEO-UHFFFAOYSA-N
MW1841.96 g/mol
LogP38.86
Rot. Bonds15

About 4-(1-benzofuran-2-yl)-N-phenylaniline;N-[4-(1-benzofuran-2-yl)phenyl]-6-[7-[6-(N-[4-(1-benzofuran-2-yl)phenyl]anilino)naphthalen-2-yl]-[1]benzofuro[5,6-f][1]benzofuran-2-yl]-N-phenylnaphthalen-2-amine;2,7-bis(6-chloronaphthalen-2-yl)-[1]benzofuro[5,6-f][1]benzofuran

4-(1-benzofuran-2-yl)-N-phenylaniline;N-[4-(1-benzofuran-2-yl)phenyl]-6-[7-[6-(N-[4-(1-benzofuran-2-yl)phenyl]anilino)naphthalen-2-yl]-[1]benzofuro[5,6-f][1]benzofuran-2-yl]-N-phenylnaphthalen-2-amine;2,7-bis(6-chloronaphthalen-2-yl)-[1]benzofuro[5,6-f][1]benzofuran (PubChem CID 160681613) has the molecular formula C128H79Cl2N3O7 and a molecular weight of 1841.96 g/mol. Its IUPAC name is 4-(1-benzofuran-2-yl)-N-phenylaniline;N-[4-(1-benzofuran-2-yl)phenyl]-6-[7-[6-(N-[4-(1-benzofuran-2-yl)phenyl]anilino)naphthalen-2-yl]-[1]benzofuro[5,6-f][1]benzofuran-2-yl]-N-phenylnaphthalen-2-amine;2,7-bis(6-chloronaphthalen-2-yl)-[1]benzofuro[5,6-f][1]benzofuran.

Molecular Properties

Compound Name4-(1-benzofuran-2-yl)-N-phenylaniline;N-[4-(1-benzofuran-2-yl)phenyl]-6-[7-[6-(N-[4-(1-benzofuran-2-yl)phenyl]anilino)naphthalen-2-yl]-[1]benzofuro[5,6-f][1]benzofuran-2-yl]-N-phenylnaphthalen-2-amine;2,7-bis(6-chloronaphthalen-2-yl)-[1]benzofuro[5,6-f][1]benzofuran
PubChem CID160681613
Molecular FormulaC128H79Cl2N3O7
Molecular Weight1841.96 g/mol
Exact Mass1839.53
IUPAC Name4-(1-benzofuran-2-yl)-N-phenylaniline;N-[4-(1-benzofuran-2-yl)phenyl]-6-[7-[6-(N-[4-(1-benzofuran-2-yl)phenyl]anilino)naphthalen-2-yl]-[1]benzofuro[5,6-f][1]benzofuran-2-yl]-N-phenylnaphthalen-2-amine;2,7-bis(6-chloronaphthalen-2-yl)-[1]benzofuro[5,6-f][1]benzofuran
SMILESClc1ccc2cc(-c3cc4cc5cc6cc(-c7ccc8cc(Cl)ccc8c7)oc6cc5cc4o3)ccc2c1.c1ccc(N(c2ccc(-c3cc4ccccc4o3)cc2)c2ccc3cc(-c4cc5cc6cc7cc(-c8ccc9cc(N(c%10ccccc%10)c%10ccc(-c%11cc%12ccccc%12o%11)cc%10)ccc9c8)oc7cc6cc5o4)ccc3c2)cc1.c1ccc(Nc2ccc(-c3cc4ccccc4o3)cc2)cc1
InChIInChI=1S/C74H46N2O4.C34H18Cl2O2.C20H15NO/c1-3-13-61(14-4-1)75(63-29-23-47(24-30-63)69-41-53-11-7-9-17-67(53)77-69)65-33-27-49-35-55(21-19-51(49)39-65)71-45-59-37-57-38-60-46-72(80-74(60)44-58(57)43-73(59)79-71)56-22-20-52-40-66(34-28-50(52)36-56)76(62-15-5-2-6-16-62)64-31-25-48(26-32-64)70-42-54-12-8-10-18-68(54)78-70;35-29-7-5-19-9-23(3-1-21(19)13-29)31-17-27-11-25-12-28-18-32(38-34(28)16-26(25)15-33(27)37-31)24-4-2-22-14-30(36)8-6-20(22)10-24;1-2-7-17(8-3-1)21-18-12-10-15(11-13-18)20-14-16-6-4-5-9-19(16)22-20/h1-46H;1-18H;1-14,21H
InChIKeyROFJBYTWZGRZEO-UHFFFAOYSA-N
XLogP38.86
TPSA110.49 Ų
H-Bond Donors1
H-Bond Acceptors10
Rotatable Bonds15
Heavy Atoms140
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001841.96
LogP ≤ 538.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1010

Analyze 4-(1-benzofuran-2-yl)-N-phenylaniline;N-[4-(1-benzofuran-2-yl)phenyl]-6-[7-[6-(N-[4-(1-benzofuran-2-yl)phenyl]anilino)naphthalen-2-yl]-[1]benzofuro[5,6-f][1]benzofuran-2-yl]-N-phenylnaphthalen-2-amine;2,7-bis(6-chloronaphthalen-2-yl)-[1]benzofuro[5,6-f][1]benzofuran with MolForge

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Related Compounds

7-N,19-N-bis[6-(1-benzofuran-2-yl)naphthalen-2-yl]-7-N,19-N-diphenyl-10,16-dioxahexacyclo[11.11.0.03,11.04,9.015,23.017,22]tetracosa-1,3(11),4(9),5,7,12,14,17(22),18,20,23-undecaene-7,19-diamine
CID 134560112
N,N-bis[4-[4-(1-benzofuran-2-yl)phenyl]phenyl]naphthalen-2-amine;N,N-bis[4-[4-(1-benzofuran-2-yl)phenyl]phenyl]-4-phenylaniline
CID 165085656
4-(1-benzofuran-2-yl)-N,N-diphenylaniline
CID 139080403
N-[3-(1-benzofuran-2-yl)phenyl]-N-[4-(2-phenylphenyl)phenyl]naphthalen-2-amine
CID 170398533
4-[4-(1-benzofuran-2-yl)phenyl]-N-[4-[4-(1-benzofuran-2-yl)phenyl]phenyl]-N-phenylaniline
CID 164744662
N-[3-(1-benzofuran-2-yl)phenyl]-N-(4-naphthalen-2-ylphenyl)-3-phenylaniline
CID 170398637
6-[3-(1-benzofuran-2-yl)phenyl]-N-(4-naphthalen-2-ylphenyl)-N-(4-phenylphenyl)naphthalen-2-amine
CID 170400574
N-[3-(1-benzofuran-2-yl)phenyl]-N-(4-naphthalen-2-ylphenyl)naphthalen-2-amine
CID 170398550
N-[4-(1-benzofuran-2-yl)phenyl]-N-[4-[4-(1-benzofuran-2-yl)phenyl]phenyl]-4-phenylaniline;N,N-bis[4-(1-benzofuran-2-yl)phenyl]-4-naphthalen-2-ylaniline;N,N-bis[4-(1-benzofuran-2-yl)phenyl]-4-(4-naphthalen-2-ylphenyl)aniline;N,4-bis[4-(1-benzofuran-2-yl)phenyl]-N-(4-naphthalen-2-ylphenyl)aniline
CID 165046109
N-[3-(1-benzofuran-2-yl)phenyl]-N-[4-(3,5-diphenylphenyl)phenyl]naphthalen-2-amine
CID 170398542
3-(1-benzofuran-2-yl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-N-(4-phenylphenyl)aniline
CID 170402049
3-(1-benzofuran-2-yl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-N-phenylaniline
CID 170402040

Frequently Asked Questions

What is the IUPAC name of 4-(1-benzofuran-2-yl)-N-phenylaniline;N-[4-(1-benzofuran-2-yl)phenyl]-6-[7-[6-(N-[4-(1-benzofuran-2-yl)phenyl]anilino)naphthalen-2-yl]-[1]benzofuro[5,6-f][1]benzofuran-2-yl]-N-phenylnaphthalen-2-amine;2,7-bis(6-chloronaphthalen-2-yl)-[1]benzofuro[5,6-f][1]benzofuran?
The IUPAC name of 4-(1-benzofuran-2-yl)-N-phenylaniline;N-[4-(1-benzofuran-2-yl)phenyl]-6-[7-[6-(N-[4-(1-benzofuran-2-yl)phenyl]anilino)naphthalen-2-yl]-[1]benzofuro[5,6-f][1]benzofuran-2-yl]-N-phenylnaphthalen-2-amine;2,7-bis(6-chloronaphthalen-2-yl)-[1]benzofuro[5,6-f][1]benzofuran (CID 160681613) is 4-(1-benzofuran-2-yl)-N-phenylaniline;N-[4-(1-benzofuran-2-yl)phenyl]-6-[7-[6-(N-[4-(1-benzofuran-2-yl)phenyl]anilino)naphthalen-2-yl]-[1]benzofuro[5,6-f][1]benzofuran-2-yl]-N-phenylnaphthalen-2-amine;2,7-bis(6-chloronaphthalen-2-yl)-[1]benzofuro[5,6-f][1]benzofuran.
What is the SMILES notation for 4-(1-benzofuran-2-yl)-N-phenylaniline;N-[4-(1-benzofuran-2-yl)phenyl]-6-[7-[6-(N-[4-(1-benzofuran-2-yl)phenyl]anilino)naphthalen-2-yl]-[1]benzofuro[5,6-f][1]benzofuran-2-yl]-N-phenylnaphthalen-2-amine;2,7-bis(6-chloronaphthalen-2-yl)-[1]benzofuro[5,6-f][1]benzofuran?
The canonical SMILES for 4-(1-benzofuran-2-yl)-N-phenylaniline;N-[4-(1-benzofuran-2-yl)phenyl]-6-[7-[6-(N-[4-(1-benzofuran-2-yl)phenyl]anilino)naphthalen-2-yl]-[1]benzofuro[5,6-f][1]benzofuran-2-yl]-N-phenylnaphthalen-2-amine;2,7-bis(6-chloronaphthalen-2-yl)-[1]benzofuro[5,6-f][1]benzofuran is Clc1ccc2cc(-c3cc4cc5cc6cc(-c7ccc8cc(Cl)ccc8c7)oc6cc5cc4o3)ccc2c1.c1ccc(N(c2ccc(-c3cc4ccccc4o3)cc2)c2ccc3cc(-c4cc5cc6cc7cc(-c8ccc9cc(N(c%10ccccc%10)c%10ccc(-c%11cc%12ccccc%12o%11)cc%10)ccc9c8)oc7cc6cc5o4)ccc3c2)cc1.c1ccc(Nc2ccc(-c3cc4ccccc4o3)cc2)cc1.
What is the InChIKey of 4-(1-benzofuran-2-yl)-N-phenylaniline;N-[4-(1-benzofuran-2-yl)phenyl]-6-[7-[6-(N-[4-(1-benzofuran-2-yl)phenyl]anilino)naphthalen-2-yl]-[1]benzofuro[5,6-f][1]benzofuran-2-yl]-N-phenylnaphthalen-2-amine;2,7-bis(6-chloronaphthalen-2-yl)-[1]benzofuro[5,6-f][1]benzofuran?
The InChIKey is ROFJBYTWZGRZEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C74H46N2O4.C34H18Cl2O2.C20H15NO/c1-3-13-61(14-4-1)75(63-29-23-47(24-30-63)69-41-53-11-7-9-17-67(53)77-69)65-33-27-49-35-55(21-19-51(49)39-65)71-45-59-37-57-38-60-46-72(80-74(60)44-58(57)43-73(59)79-71)56-22-20-52-40-66(34-28-50(52)36-56)76(62-15-5-2-6-16-62)64-31-25-48(26-32-64)70-42-54-12-8-10-18-68(54)78-70;35-29-7-5-19-9-23(3-1-21(19)13-29)31-17-27-11-25-12-28-18-32(38-34(28)16-26(25)15-33(27)37-31)24-4-2-22-14-30(36)8-6-20(22)10-24;1-2-7-17(8-3-1)21-18-12-10-15(11-13-18)20-14-16-6-4-5-9-19(16)22-20/h1-46H;1-18H;1-14,21H.
What are the key properties of 4-(1-benzofuran-2-yl)-N-phenylaniline;N-[4-(1-benzofuran-2-yl)phenyl]-6-[7-[6-(N-[4-(1-benzofuran-2-yl)phenyl]anilino)naphthalen-2-yl]-[1]benzofuro[5,6-f][1]benzofuran-2-yl]-N-phenylnaphthalen-2-amine;2,7-bis(6-chloronaphthalen-2-yl)-[1]benzofuro[5,6-f][1]benzofuran?
4-(1-benzofuran-2-yl)-N-phenylaniline;N-[4-(1-benzofuran-2-yl)phenyl]-6-[7-[6-(N-[4-(1-benzofuran-2-yl)phenyl]anilino)naphthalen-2-yl]-[1]benzofuro[5,6-f][1]benzofuran-2-yl]-N-phenylnaphthalen-2-amine;2,7-bis(6-chloronaphthalen-2-yl)-[1]benzofuro[5,6-f][1]benzofuran has a molecular weight of 1841.96 g/mol, XLogP of 38.86, 15 rotatable bonds, 1 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-benzofuran-2-yl)-N-phenylaniline;N-[4-(1-benzofuran-2-yl)phenyl]-6-[7-[6-(N-[4-(1-benzofuran-2-yl)phenyl]anilino)naphthalen-2-yl]-[1]benzofuro[5,6-f][1]benzofuran-2-yl]-N-phenylnaphthalen-2-amine;2,7-bis(6-chloronaphthalen-2-yl)-[1]benzofuro[5,6-f][1]benzofuran is sourced from PubChem (CID 160681613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).