1-phenyl-10-[4-[4-(4-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-a]carbazole

C46H30N4 — CID 90062409

IUPAC1-phenyl-10-[4-[4-(4-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-a]carbazole
SMILESc1ccc(-c2ccc(-c3nc(-c4ccc(-n5c6ccccc6c6ccc7ccn(-c8ccccc8)c7c65)cc4)nc4ccccc34)cc2)cc1
InChIInChI=1S/C46H30N4/c1-3-11-31(12-4-1)32-19-21-33(22-20-32)43-40-16-7-9-17-41(40)47-46(48-43)35-23-26-37(27-24-35)50-42-18-10-8-15-38(42)39-28-25-34-29-30-49(44(34)45(39)50)36-13-5-2-6-14-36/h1-30H
InChIKeyFOVAJRITJMNTAI-UHFFFAOYSA-N
MW638.77 g/mol
LogP11.67
Rot. Bonds5

About 1-phenyl-10-[4-[4-(4-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-a]carbazole

1-phenyl-10-[4-[4-(4-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-a]carbazole (PubChem CID 90062409) has the molecular formula C46H30N4 and a molecular weight of 638.77 g/mol. Its IUPAC name is 1-phenyl-10-[4-[4-(4-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-a]carbazole.

Molecular Properties

Compound Name1-phenyl-10-[4-[4-(4-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-a]carbazole
PubChem CID90062409
Molecular FormulaC46H30N4
Molecular Weight638.77 g/mol
Exact Mass638.25
IUPAC Name1-phenyl-10-[4-[4-(4-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-a]carbazole
SMILESc1ccc(-c2ccc(-c3nc(-c4ccc(-n5c6ccccc6c6ccc7ccn(-c8ccccc8)c7c65)cc4)nc4ccccc34)cc2)cc1
InChIInChI=1S/C46H30N4/c1-3-11-31(12-4-1)32-19-21-33(22-20-32)43-40-16-7-9-17-41(40)47-46(48-43)35-23-26-37(27-24-35)50-42-18-10-8-15-38(42)39-28-25-34-29-30-49(44(34)45(39)50)36-13-5-2-6-14-36/h1-30H
InChIKeyFOVAJRITJMNTAI-UHFFFAOYSA-N
XLogP11.67
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500638.77
LogP ≤ 511.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-phenyl-10-[4-[4-(4-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-a]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

10-[4-[4-(4-naphthalen-1-ylphenyl)quinazolin-2-yl]phenyl]-1-phenylpyrrolo[2,3-a]carbazole
CID 90062413
10-[4-[4-(3,5-diphenylphenyl)quinazolin-2-yl]phenyl]-1-phenylpyrrolo[2,3-a]carbazole;10-[4-[4-(4,6-diphenyl-2-pyridinyl)quinazolin-2-yl]phenyl]-1-phenylpyrrolo[2,3-a]carbazole;1-phenyl-10-[4-[4-(2-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-a]carbazole
CID 158136227
1-phenyl-10-[4-(4-phenylphenyl)-6-(1-phenylpyrrolo[2,3-a]carbazol-10-yl)-1,3,5-triazin-2-yl]pyrrolo[2,3-a]carbazole
CID 90091343
11-phenyl-3-(9-phenylcarbazol-3-yl)-12-[4-(4-phenylquinazolin-2-yl)phenyl]indolo[2,3-a]carbazole
CID 67701976
10-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]pyrrolo[2,3-a]carbazole
CID 118315994
11-phenyl-12-[4-[4-(4-phenylphenyl)quinazolin-2-yl]phenyl]indolo[2,3-i]phenanthridine
CID 129122934
5-(4-phenylphenyl)-12-[4-(4-phenylquinazolin-2-yl)phenyl]indolo[3,2-c]carbazole
CID 135166213
10-[3-(2,6-diphenylpyrimidin-4-yl)-5-phenylphenyl]-1-phenylpyrrolo[2,3-a]carbazole
CID 90130670
1,6-diphenyl-9-(4-phenylquinazolin-2-yl)pyrrolo[3,2-c]carbazole
CID 118317506
1-phenyl-10-[2-phenyl-6-(1-phenylpyrrolo[2,3-a]carbazol-10-yl)pyrimidin-4-yl]pyrrolo[2,3-a]carbazole
CID 90091012
1-phenyl-6-[3-[4-(4-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[3,2-c]carbazole
CID 118317427
1-(3,5-diphenylphenyl)-10-[4-[4-[1-(3,5-diphenylphenyl)pyrrolo[2,3-a]carbazol-10-yl]phenyl]phenyl]pyrrolo[2,3-a]carbazole
CID 90090913

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-10-[4-[4-(4-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-a]carbazole?
The IUPAC name of 1-phenyl-10-[4-[4-(4-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-a]carbazole (CID 90062409) is 1-phenyl-10-[4-[4-(4-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-a]carbazole.
What is the SMILES notation for 1-phenyl-10-[4-[4-(4-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-a]carbazole?
The canonical SMILES for 1-phenyl-10-[4-[4-(4-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-a]carbazole is c1ccc(-c2ccc(-c3nc(-c4ccc(-n5c6ccccc6c6ccc7ccn(-c8ccccc8)c7c65)cc4)nc4ccccc34)cc2)cc1.
What is the InChIKey of 1-phenyl-10-[4-[4-(4-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-a]carbazole?
The InChIKey is FOVAJRITJMNTAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H30N4/c1-3-11-31(12-4-1)32-19-21-33(22-20-32)43-40-16-7-9-17-41(40)47-46(48-43)35-23-26-37(27-24-35)50-42-18-10-8-15-38(42)39-28-25-34-29-30-49(44(34)45(39)50)36-13-5-2-6-14-36/h1-30H.
What are the key properties of 1-phenyl-10-[4-[4-(4-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-a]carbazole?
1-phenyl-10-[4-[4-(4-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-a]carbazole has a molecular weight of 638.77 g/mol, XLogP of 11.67, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-10-[4-[4-(4-phenylphenyl)quinazolin-2-yl]phenyl]pyrrolo[2,3-a]carbazole is sourced from PubChem (CID 90062409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).