2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)naphthalen-1-yl]-3-phenylquinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylbenzo[f]quinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylquinoxaline

C155H100N6 — CID 161422576

IUPAC2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)naphthalen-1-yl]-3-phenylquinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylbenzo[f]quinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylquinoxaline
SMILESc1ccc(-c2nc3ccc4ccccc4c3nc2-c2ccc(-c3ccc4c5c(ccc4c3)-c3ccccc3C5(c3ccccc3)c3ccccc3)cc2)cc1.c1ccc(-c2nc3ccccc3nc2-c2ccc(-c3ccc4c5c(ccc4c3)-c3ccccc3C5(c3ccccc3)c3ccccc3)c3ccccc23)cc1.c1ccc(-c2nc3ccccc3nc2-c2ccc(-c3ccc4c5c(ccc4c3)-c3ccccc3C5(c3ccccc3)c3ccccc3)cc2)cc1
InChIInChI=1S/2C53H34N2.C49H32N2/c1-4-16-35(17-5-1)51-52(55-49-27-15-14-26-48(49)54-51)46-33-32-40(42-22-10-11-23-43(42)46)36-28-30-41-37(34-36)29-31-45-44-24-12-13-25-47(44)53(50(41)45,38-18-6-2-7-19-38)39-20-8-3-9-21-39;1-4-15-37(16-5-1)50-51(55-52-44-21-11-10-14-36(44)30-33-48(52)54-50)38-26-24-35(25-27-38)39-28-31-43-40(34-39)29-32-46-45-22-12-13-23-47(45)53(49(43)46,41-17-6-2-7-18-41)42-19-8-3-9-20-42;1-4-14-34(15-5-1)47-48(51-45-23-13-12-22-44(45)50-47)35-26-24-33(25-27-35)36-28-30-40-37(32-36)29-31-42-41-20-10-11-21-43(41)49(46(40)42,38-16-6-2-7-17-38)39-18-8-3-9-19-39/h2*1-34H;1-32H
InChIKeyVWXWMPLNXGUCCX-UHFFFAOYSA-N
MW2046.55 g/mol
LogP38.75
Rot. Bonds15

About 2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)naphthalen-1-yl]-3-phenylquinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylbenzo[f]quinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylquinoxaline

2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)naphthalen-1-yl]-3-phenylquinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylbenzo[f]quinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylquinoxaline (PubChem CID 161422576) has the molecular formula C155H100N6 and a molecular weight of 2046.55 g/mol. Its IUPAC name is 2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)naphthalen-1-yl]-3-phenylquinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylbenzo[f]quinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylquinoxaline.

Molecular Properties

Compound Name2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)naphthalen-1-yl]-3-phenylquinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylbenzo[f]quinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylquinoxaline
PubChem CID161422576
Molecular FormulaC155H100N6
Molecular Weight2046.55 g/mol
Exact Mass2044.80
IUPAC Name2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)naphthalen-1-yl]-3-phenylquinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylbenzo[f]quinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylquinoxaline
SMILESc1ccc(-c2nc3ccc4ccccc4c3nc2-c2ccc(-c3ccc4c5c(ccc4c3)-c3ccccc3C5(c3ccccc3)c3ccccc3)cc2)cc1.c1ccc(-c2nc3ccccc3nc2-c2ccc(-c3ccc4c5c(ccc4c3)-c3ccccc3C5(c3ccccc3)c3ccccc3)c3ccccc23)cc1.c1ccc(-c2nc3ccccc3nc2-c2ccc(-c3ccc4c5c(ccc4c3)-c3ccccc3C5(c3ccccc3)c3ccccc3)cc2)cc1
InChIInChI=1S/2C53H34N2.C49H32N2/c1-4-16-35(17-5-1)51-52(55-49-27-15-14-26-48(49)54-51)46-33-32-40(42-22-10-11-23-43(42)46)36-28-30-41-37(34-36)29-31-45-44-24-12-13-25-47(44)53(50(41)45,38-18-6-2-7-19-38)39-20-8-3-9-21-39;1-4-15-37(16-5-1)50-51(55-52-44-21-11-10-14-36(44)30-33-48(52)54-50)38-26-24-35(25-27-38)39-28-31-43-40(34-39)29-32-46-45-22-12-13-23-47(45)53(49(43)46,41-17-6-2-7-18-41)42-19-8-3-9-20-42;1-4-14-34(15-5-1)47-48(51-45-23-13-12-22-44(45)50-47)35-26-24-33(25-27-35)36-28-30-40-37(32-36)29-31-42-41-20-10-11-21-43(41)49(46(40)42,38-16-6-2-7-17-38)39-18-8-3-9-19-39/h2*1-34H;1-32H
InChIKeyVWXWMPLNXGUCCX-UHFFFAOYSA-N
XLogP38.75
TPSA77.34 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds15
Heavy Atoms161
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002046.55
LogP ≤ 538.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)naphthalen-1-yl]-3-phenylquinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylbenzo[f]quinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylquinoxaline 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

2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylbenzo[f]quinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylquinoxaline
CID 157197876
3-[3-(11,11-diphenylbenzo[b]fluoren-7-yl)phenyl]-2-phenylbenzo[f]quinoxaline
CID 155465522
2-(11,11-diphenylbenzo[b]fluoren-8-yl)-3-phenylbenzo[f]quinoxaline
CID 155465596
3-phenanthren-9-yl-11,11-diphenylbenzo[a]fluorene
CID 166034552
2-(16,16-dimethyl-6-hexacyclo[12.11.0.02,11.03,8.015,23.017,22]pentacosa-1(14),2(11),3(8),4,6,9,12,15(23),17,19,21,24-dodecaenyl)-3-phenylbenzo[f]quinoxaline
CID 164721653
2-(11,11-dimethylbenzo[b]fluoren-8-yl)-3-phenylbenzo[f]quinoxaline;3-(11,11-diphenylbenzo[b]fluoren-8-yl)-2-phenylbenzo[f]quinoxaline;2-(11,11-diphenylbenzo[b]fluoren-8-yl)-3-phenylquinoxaline
CID 161218140
2-[4-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)naphthalen-1-yl]phenyl]-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine
CID 155465924
2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)naphthalen-2-yl]-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 155465377
2-[4-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)naphthalen-1-yl]phenyl]-4-[3-[2-[3-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-11,11-diphenylbenzo[a]fluoren-8-yl]phenyl]-6-naphthalen-2-yl-1,3,5-triazine
CID 155465388
3-(3,5-dinaphthalen-2-ylphenyl)-11,11-diphenylbenzo[a]fluorene
CID 166034195
2-[4-(11,11-diphenylbenzo[a]fluoren-4-yl)phenyl]-4-phenylbenzo[h]quinazoline
CID 155465892
2-(11,11-diphenylbenzo[b]fluoren-6-yl)-3-phenylquinoxaline
CID 155465410

Frequently Asked Questions

What is the IUPAC name of 2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)naphthalen-1-yl]-3-phenylquinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylbenzo[f]quinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylquinoxaline?
The IUPAC name of 2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)naphthalen-1-yl]-3-phenylquinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylbenzo[f]quinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylquinoxaline (CID 161422576) is 2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)naphthalen-1-yl]-3-phenylquinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylbenzo[f]quinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylquinoxaline.
What is the SMILES notation for 2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)naphthalen-1-yl]-3-phenylquinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylbenzo[f]quinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylquinoxaline?
The canonical SMILES for 2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)naphthalen-1-yl]-3-phenylquinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylbenzo[f]quinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylquinoxaline is c1ccc(-c2nc3ccc4ccccc4c3nc2-c2ccc(-c3ccc4c5c(ccc4c3)-c3ccccc3C5(c3ccccc3)c3ccccc3)cc2)cc1.c1ccc(-c2nc3ccccc3nc2-c2ccc(-c3ccc4c5c(ccc4c3)-c3ccccc3C5(c3ccccc3)c3ccccc3)c3ccccc23)cc1.c1ccc(-c2nc3ccccc3nc2-c2ccc(-c3ccc4c5c(ccc4c3)-c3ccccc3C5(c3ccccc3)c3ccccc3)cc2)cc1.
What is the InChIKey of 2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)naphthalen-1-yl]-3-phenylquinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylbenzo[f]quinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylquinoxaline?
The InChIKey is VWXWMPLNXGUCCX-UHFFFAOYSA-N. The full InChI is InChI=1S/2C53H34N2.C49H32N2/c1-4-16-35(17-5-1)51-52(55-49-27-15-14-26-48(49)54-51)46-33-32-40(42-22-10-11-23-43(42)46)36-28-30-41-37(34-36)29-31-45-44-24-12-13-25-47(44)53(50(41)45,38-18-6-2-7-19-38)39-20-8-3-9-21-39;1-4-15-37(16-5-1)50-51(55-52-44-21-11-10-14-36(44)30-33-48(52)54-50)38-26-24-35(25-27-38)39-28-31-43-40(34-39)29-32-46-45-22-12-13-23-47(45)53(49(43)46,41-17-6-2-7-18-41)42-19-8-3-9-20-42;1-4-14-34(15-5-1)47-48(51-45-23-13-12-22-44(45)50-47)35-26-24-33(25-27-35)36-28-30-40-37(32-36)29-31-42-41-20-10-11-21-43(41)49(46(40)42,38-16-6-2-7-17-38)39-18-8-3-9-19-39/h2*1-34H;1-32H.
What are the key properties of 2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)naphthalen-1-yl]-3-phenylquinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylbenzo[f]quinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylquinoxaline?
2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)naphthalen-1-yl]-3-phenylquinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylbenzo[f]quinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylquinoxaline has a molecular weight of 2046.55 g/mol, XLogP of 38.75, 15 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)naphthalen-1-yl]-3-phenylquinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylbenzo[f]quinoxaline;2-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)phenyl]-3-phenylquinoxaline is sourced from PubChem (CID 161422576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).