2-benzo[c]carbazol-7-yl-5-(4-phenylbenzo[h]quinazolin-2-yl)benzo[b]carbazole

C50H30N4 — CID 146375723

IUPAC2-benzo[c]carbazol-7-yl-5-(4-phenylbenzo[h]quinazolin-2-yl)benzo[b]carbazole
SMILESc1ccc(-c2nc(-n3c4ccc(-n5c6ccccc6c6c7ccccc7ccc65)cc4c4cc5ccccc5cc43)nc3c2ccc2ccccc23)cc1
InChIInChI=1S/C50H30N4/c1-2-14-33(15-3-1)48-40-25-22-32-13-7-9-19-38(32)49(40)52-50(51-48)54-44-27-24-36(30-42(44)41-28-34-16-4-5-17-35(34)29-46(41)54)53-43-21-11-10-20-39(43)47-37-18-8-6-12-31(37)23-26-45(47)53/h1-30H
InChIKeyPAMYJTJUPKGUNA-UHFFFAOYSA-N
MW686.82 g/mol
LogP12.95
Rot. Bonds3

About 2-benzo[c]carbazol-7-yl-5-(4-phenylbenzo[h]quinazolin-2-yl)benzo[b]carbazole

2-benzo[c]carbazol-7-yl-5-(4-phenylbenzo[h]quinazolin-2-yl)benzo[b]carbazole (PubChem CID 146375723) has the molecular formula C50H30N4 and a molecular weight of 686.82 g/mol. Its IUPAC name is 2-benzo[c]carbazol-7-yl-5-(4-phenylbenzo[h]quinazolin-2-yl)benzo[b]carbazole.

Molecular Properties

Compound Name2-benzo[c]carbazol-7-yl-5-(4-phenylbenzo[h]quinazolin-2-yl)benzo[b]carbazole
PubChem CID146375723
Molecular FormulaC50H30N4
Molecular Weight686.82 g/mol
Exact Mass686.25
IUPAC Name2-benzo[c]carbazol-7-yl-5-(4-phenylbenzo[h]quinazolin-2-yl)benzo[b]carbazole
SMILESc1ccc(-c2nc(-n3c4ccc(-n5c6ccccc6c6c7ccccc7ccc65)cc4c4cc5ccccc5cc43)nc3c2ccc2ccccc23)cc1
InChIInChI=1S/C50H30N4/c1-2-14-33(15-3-1)48-40-25-22-32-13-7-9-19-38(32)49(40)52-50(51-48)54-44-27-24-36(30-42(44)41-28-34-16-4-5-17-35(34)29-46(41)54)53-43-21-11-10-20-39(43)47-37-18-8-6-12-31(37)23-26-45(47)53/h1-30H
InChIKeyPAMYJTJUPKGUNA-UHFFFAOYSA-N
XLogP12.95
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms54
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500686.82
LogP ≤ 512.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-benzo[c]carbazol-7-yl-5-(4-phenylbenzo[h]quinazolin-2-yl)benzo[b]carbazole 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

3-benzo[c]carbazol-7-yl-5-[4-(4-phenylphenyl)quinazolin-2-yl]benzo[b]carbazole
CID 146375569
2-benzo[c]carbazol-7-yl-5-[4-(3,5-diphenylphenyl)quinazolin-2-yl]benzo[b]carbazole
CID 146375215
7-phenyl-10-[9-(4-phenylbenzo[h]quinazolin-2-yl)carbazol-3-yl]benzo[c]carbazole
CID 155153254
2-(3-carbazol-9-ylcarbazol-9-yl)-4-[6-(3-carbazol-9-ylcarbazol-9-yl)naphthalen-2-yl]benzo[h]quinazoline
CID 121401988
9-benzo[b]carbazol-5-yl-7-[4-(9-phenylcarbazol-2-yl)quinazolin-2-yl]benzo[c]carbazole
CID 162481400
2-carbazol-9-yl-5-(4-phenylquinazolin-2-yl)benzo[b]carbazole
CID 146374838
2-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-4-(4-phenylphenyl)benzo[h]quinazoline
CID 130355727
4-phenyl-2-[2-(9-phenylcarbazol-2-yl)carbazol-9-yl]benzo[h]quinazoline
CID 121402040
2-(3-naphthalen-2-ylcarbazol-9-yl)-4-phenylbenzo[h]quinazoline
CID 122497106
2-[3-(6,9-diphenylcarbazol-3-yl)-6-phenylcarbazol-9-yl]-4-(4-phenylphenyl)benzo[h]quinazoline
CID 121402019
9-phenyl-6-[7-(4-phenylbenzo[h]quinazolin-2-yl)benzo[c]carbazol-10-yl]carbazole-3-thiol
CID 131998699
10-benzo[b]carbazol-5-yl-7-[4-(2-phenylphenyl)quinazolin-2-yl]benzo[c]carbazole
CID 161141967

Frequently Asked Questions

What is the IUPAC name of 2-benzo[c]carbazol-7-yl-5-(4-phenylbenzo[h]quinazolin-2-yl)benzo[b]carbazole?
The IUPAC name of 2-benzo[c]carbazol-7-yl-5-(4-phenylbenzo[h]quinazolin-2-yl)benzo[b]carbazole (CID 146375723) is 2-benzo[c]carbazol-7-yl-5-(4-phenylbenzo[h]quinazolin-2-yl)benzo[b]carbazole.
What is the SMILES notation for 2-benzo[c]carbazol-7-yl-5-(4-phenylbenzo[h]quinazolin-2-yl)benzo[b]carbazole?
The canonical SMILES for 2-benzo[c]carbazol-7-yl-5-(4-phenylbenzo[h]quinazolin-2-yl)benzo[b]carbazole is c1ccc(-c2nc(-n3c4ccc(-n5c6ccccc6c6c7ccccc7ccc65)cc4c4cc5ccccc5cc43)nc3c2ccc2ccccc23)cc1.
What is the InChIKey of 2-benzo[c]carbazol-7-yl-5-(4-phenylbenzo[h]quinazolin-2-yl)benzo[b]carbazole?
The InChIKey is PAMYJTJUPKGUNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H30N4/c1-2-14-33(15-3-1)48-40-25-22-32-13-7-9-19-38(32)49(40)52-50(51-48)54-44-27-24-36(30-42(44)41-28-34-16-4-5-17-35(34)29-46(41)54)53-43-21-11-10-20-39(43)47-37-18-8-6-12-31(37)23-26-45(47)53/h1-30H.
What are the key properties of 2-benzo[c]carbazol-7-yl-5-(4-phenylbenzo[h]quinazolin-2-yl)benzo[b]carbazole?
2-benzo[c]carbazol-7-yl-5-(4-phenylbenzo[h]quinazolin-2-yl)benzo[b]carbazole has a molecular weight of 686.82 g/mol, XLogP of 12.95, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzo[c]carbazol-7-yl-5-(4-phenylbenzo[h]quinazolin-2-yl)benzo[b]carbazole is sourced from PubChem (CID 146375723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).