1-bromodibenzofuran;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]dibenzofuran-1-amine;4-[4-[[4-(4-naphthalen-1-ylphenyl)phenyl]methyl]phenyl]dibenzofuran

C105H68BrNO4 — CID 159126072

IUPAC1-bromodibenzofuran;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]dibenzofuran-1-amine;4-[4-[[4-(4-naphthalen-1-ylphenyl)phenyl]methyl]phenyl]dibenzofuran
SMILESBrc1cccc2oc3ccccc3c12.c1ccc2c(-c3ccc(-c4ccc(Cc5ccc(-c6cccc7c6oc6ccccc67)cc5)cc4)cc3)cccc2c1.c1ccc2c(-c3ccc(-c4ccc(N(c5ccc(-c6cccc7c6oc6ccccc67)cc5)c5cccc6oc7ccccc7c56)cc4)cc3)cccc2c1
InChIInChI=1S/C52H33NO2.C41H28O.C12H7BrO/c1-2-12-41-36(10-1)11-7-15-42(41)37-24-22-34(23-25-37)35-26-30-39(31-27-35)53(47-18-9-21-50-51(47)46-14-4-6-20-49(46)54-50)40-32-28-38(29-33-40)43-16-8-17-45-44-13-3-5-19-48(44)55-52(43)45;1-2-9-35-32(7-1)8-5-11-36(35)33-25-23-31(24-26-33)30-19-15-28(16-20-30)27-29-17-21-34(22-18-29)37-12-6-13-39-38-10-3-4-14-40(38)42-41(37)39;13-9-5-3-7-11-12(9)8-4-1-2-6-10(8)14-11/h1-33H;1-26H,27H2;1-7H
InChIKeyKGHDHDZQLWYUCB-UHFFFAOYSA-N
MW1487.61 g/mol
LogP30.79
Rot. Bonds11

About 1-bromodibenzofuran;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]dibenzofuran-1-amine;4-[4-[[4-(4-naphthalen-1-ylphenyl)phenyl]methyl]phenyl]dibenzofuran

1-bromodibenzofuran;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]dibenzofuran-1-amine;4-[4-[[4-(4-naphthalen-1-ylphenyl)phenyl]methyl]phenyl]dibenzofuran (PubChem CID 159126072) has the molecular formula C105H68BrNO4 and a molecular weight of 1487.61 g/mol. Its IUPAC name is 1-bromodibenzofuran;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]dibenzofuran-1-amine;4-[4-[[4-(4-naphthalen-1-ylphenyl)phenyl]methyl]phenyl]dibenzofuran.

Molecular Properties

Compound Name1-bromodibenzofuran;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]dibenzofuran-1-amine;4-[4-[[4-(4-naphthalen-1-ylphenyl)phenyl]methyl]phenyl]dibenzofuran
PubChem CID159126072
Molecular FormulaC105H68BrNO4
Molecular Weight1487.61 g/mol
Exact Mass1485.43
IUPAC Name1-bromodibenzofuran;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]dibenzofuran-1-amine;4-[4-[[4-(4-naphthalen-1-ylphenyl)phenyl]methyl]phenyl]dibenzofuran
SMILESBrc1cccc2oc3ccccc3c12.c1ccc2c(-c3ccc(-c4ccc(Cc5ccc(-c6cccc7c6oc6ccccc67)cc5)cc4)cc3)cccc2c1.c1ccc2c(-c3ccc(-c4ccc(N(c5ccc(-c6cccc7c6oc6ccccc67)cc5)c5cccc6oc7ccccc7c56)cc4)cc3)cccc2c1
InChIInChI=1S/C52H33NO2.C41H28O.C12H7BrO/c1-2-12-41-36(10-1)11-7-15-42(41)37-24-22-34(23-25-37)35-26-30-39(31-27-35)53(47-18-9-21-50-51(47)46-14-4-6-20-49(46)54-50)40-32-28-38(29-33-40)43-16-8-17-45-44-13-3-5-19-48(44)55-52(43)45;1-2-9-35-32(7-1)8-5-11-36(35)33-25-23-31(24-26-33)30-19-15-28(16-20-30)27-29-17-21-34(22-18-29)37-12-6-13-39-38-10-3-4-14-40(38)42-41(37)39;13-9-5-3-7-11-12(9)8-4-1-2-6-10(8)14-11/h1-33H;1-26H,27H2;1-7H
InChIKeyKGHDHDZQLWYUCB-UHFFFAOYSA-N
XLogP30.79
TPSA55.80 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms111
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001487.61
LogP ≤ 530.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-bromodibenzofuran;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]dibenzofuran-1-amine;4-[4-[[4-(4-naphthalen-1-ylphenyl)phenyl]methyl]phenyl]dibenzofuran with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N,N-bis[4-(2-phenylphenyl)phenyl]dibenzofuran-1-amine;1-bromodibenzofuran;1-phenyl-2-[4-[[4-(2-phenylphenyl)phenyl]methyl]phenyl]benzene
CID 164957469
N-(2-dibenzofuran-4-ylphenyl)-N-(4-naphthalen-1-ylphenyl)dibenzofuran-1-amine
CID 155186869
N-(4-dibenzofuran-4-ylphenyl)-2-(2-naphthalen-1-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline
CID 155374408
N-dibenzofuran-3-yl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]naphtho[1,2-b][1]benzofuran-7-amine
CID 171738699
N-(4-dibenzofuran-4-ylphenyl)-N-(4-naphthalen-2-ylphenyl)dibenzofuran-1-amine
CID 155186611
N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-phenylphenyl)phenyl]naphthalen-1-amine
CID 59136875
2-dibenzofuran-2-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]aniline
CID 167324733
N-(4-dibenzofuran-2-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]dibenzofuran-1-amine
CID 147363119
N-(4-dibenzofuran-4-ylphenyl)-4-(4-naphthalen-1-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]aniline;N-(4-dibenzofuran-4-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-4-(4-phenylphenyl)aniline
CID 159404463
2-(3-dibenzofuran-4-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)aniline
CID 126709649
N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-phenylphenyl)phenyl]phenanthren-4-amine
CID 135271698
N-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 157079303

Frequently Asked Questions

What is the IUPAC name of 1-bromodibenzofuran;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]dibenzofuran-1-amine;4-[4-[[4-(4-naphthalen-1-ylphenyl)phenyl]methyl]phenyl]dibenzofuran?
The IUPAC name of 1-bromodibenzofuran;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]dibenzofuran-1-amine;4-[4-[[4-(4-naphthalen-1-ylphenyl)phenyl]methyl]phenyl]dibenzofuran (CID 159126072) is 1-bromodibenzofuran;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]dibenzofuran-1-amine;4-[4-[[4-(4-naphthalen-1-ylphenyl)phenyl]methyl]phenyl]dibenzofuran.
What is the SMILES notation for 1-bromodibenzofuran;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]dibenzofuran-1-amine;4-[4-[[4-(4-naphthalen-1-ylphenyl)phenyl]methyl]phenyl]dibenzofuran?
The canonical SMILES for 1-bromodibenzofuran;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]dibenzofuran-1-amine;4-[4-[[4-(4-naphthalen-1-ylphenyl)phenyl]methyl]phenyl]dibenzofuran is Brc1cccc2oc3ccccc3c12.c1ccc2c(-c3ccc(-c4ccc(Cc5ccc(-c6cccc7c6oc6ccccc67)cc5)cc4)cc3)cccc2c1.c1ccc2c(-c3ccc(-c4ccc(N(c5ccc(-c6cccc7c6oc6ccccc67)cc5)c5cccc6oc7ccccc7c56)cc4)cc3)cccc2c1.
What is the InChIKey of 1-bromodibenzofuran;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]dibenzofuran-1-amine;4-[4-[[4-(4-naphthalen-1-ylphenyl)phenyl]methyl]phenyl]dibenzofuran?
The InChIKey is KGHDHDZQLWYUCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H33NO2.C41H28O.C12H7BrO/c1-2-12-41-36(10-1)11-7-15-42(41)37-24-22-34(23-25-37)35-26-30-39(31-27-35)53(47-18-9-21-50-51(47)46-14-4-6-20-49(46)54-50)40-32-28-38(29-33-40)43-16-8-17-45-44-13-3-5-19-48(44)55-52(43)45;1-2-9-35-32(7-1)8-5-11-36(35)33-25-23-31(24-26-33)30-19-15-28(16-20-30)27-29-17-21-34(22-18-29)37-12-6-13-39-38-10-3-4-14-40(38)42-41(37)39;13-9-5-3-7-11-12(9)8-4-1-2-6-10(8)14-11/h1-33H;1-26H,27H2;1-7H.
What are the key properties of 1-bromodibenzofuran;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]dibenzofuran-1-amine;4-[4-[[4-(4-naphthalen-1-ylphenyl)phenyl]methyl]phenyl]dibenzofuran?
1-bromodibenzofuran;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]dibenzofuran-1-amine;4-[4-[[4-(4-naphthalen-1-ylphenyl)phenyl]methyl]phenyl]dibenzofuran has a molecular weight of 1487.61 g/mol, XLogP of 30.79, 11 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromodibenzofuran;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]dibenzofuran-1-amine;4-[4-[[4-(4-naphthalen-1-ylphenyl)phenyl]methyl]phenyl]dibenzofuran is sourced from PubChem (CID 159126072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).