7-[10-(4-fluoronaphthalen-1-yl)anthracen-9-yl]-5-phenylpyrido[3,2-b]indole

C41H25FN2 — CID 88886589

IUPAC7-[10-(4-fluoronaphthalen-1-yl)anthracen-9-yl]-5-phenylpyrido[3,2-b]indole
SMILESFc1ccc(-c2c3ccccc3c(-c3ccc4c5ncccc5n(-c5ccccc5)c4c3)c3ccccc23)c2ccccc12
InChIInChI=1S/C41H25FN2/c42-36-23-22-34(28-13-4-5-14-29(28)36)40-32-17-8-6-15-30(32)39(31-16-7-9-18-33(31)40)26-20-21-35-38(25-26)44(27-11-2-1-3-12-27)37-19-10-24-43-41(35)37/h1-25H
InChIKeyQFZPRZHLYUFBQQ-UHFFFAOYSA-N
MW564.66 g/mol
LogP11.11
Rot. Bonds3

About 7-[10-(4-fluoronaphthalen-1-yl)anthracen-9-yl]-5-phenylpyrido[3,2-b]indole

7-[10-(4-fluoronaphthalen-1-yl)anthracen-9-yl]-5-phenylpyrido[3,2-b]indole (PubChem CID 88886589) has the molecular formula C41H25FN2 and a molecular weight of 564.66 g/mol. Its IUPAC name is 7-[10-(4-fluoronaphthalen-1-yl)anthracen-9-yl]-5-phenylpyrido[3,2-b]indole.

Molecular Properties

Compound Name7-[10-(4-fluoronaphthalen-1-yl)anthracen-9-yl]-5-phenylpyrido[3,2-b]indole
PubChem CID88886589
Molecular FormulaC41H25FN2
Molecular Weight564.66 g/mol
Exact Mass564.20
IUPAC Name7-[10-(4-fluoronaphthalen-1-yl)anthracen-9-yl]-5-phenylpyrido[3,2-b]indole
SMILESFc1ccc(-c2c3ccccc3c(-c3ccc4c5ncccc5n(-c5ccccc5)c4c3)c3ccccc23)c2ccccc12
InChIInChI=1S/C41H25FN2/c42-36-23-22-34(28-13-4-5-14-29(28)36)40-32-17-8-6-15-30(32)39(31-16-7-9-18-33(31)40)26-20-21-35-38(25-26)44(27-11-2-1-3-12-27)37-19-10-24-43-41(35)37/h1-25H
InChIKeyQFZPRZHLYUFBQQ-UHFFFAOYSA-N
XLogP11.11
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500564.66
LogP ≤ 511.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze 7-[10-(4-fluoronaphthalen-1-yl)anthracen-9-yl]-5-phenylpyrido[3,2-b]indole 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

1H-Indole, 3-((4-methyl-1-naphthalenyl)methyl)-1-pentyl-
CID 85879908
4-[1-ethyl-3-(4-fluorophenyl)-1H-pyrrolo[3,2-b]pyridin-2-yl]pyridine
CID 11012564
3-(4-Fluorophenyl)-1-methyl-2-pyridin-4-yl-1H-pyrrolo[3,2-b]pyridine
CID 11822822
1-(4-Fluoro-phenyl)-3-[4-(4-phenyl-piperazin-1-yl)-butyl]-1H-indole
CID 10365227
8-fluoro-5-(4-fluorophenyl)-2-(4-quinolin-4-ylbutyl)-3,4-dihydro-1H-pyrido[4,3-b]indole;hydrochloride
CID 13900391
Ellipticine, 6-methyl
CID 97109
(S)-1-(1H-pyrrolo[3,2-h]isoquinolin-1-yl)propan-2-amine
CID 18715558
5-fluoro-3-[4-(4-naphthalen-1-ylpiperazin-1-yl)cyclohexyl]-1H-indole
CID 44568462
1H-Indole-2-methanamine, 1-methyl-N-[3-[3-(phenylmethyl)-8-(trifluoromethyl)-4-quinolinyl]phenyl]-
CID 45272392
1H-Indole-7-methanamine, 1-methyl-N-[3-[3-(phenylmethyl)-8-(trifluoromethyl)-4-quinolinyl]phenyl]-
CID 45273258
4-(3,3-Dimethyl-6-(4-pyridinyl)-2,3-dihydro-1H-indol-1-yl)-7-fluoro-3-methyl-2-(2-pyridinyl)quinoline
CID 50940108
1-[4-[4-(4-Fluorophenyl)piperazin-1-yl]butyl]-3-phenylindole
CID 56642430

Frequently Asked Questions

What is the IUPAC name of 7-[10-(4-fluoronaphthalen-1-yl)anthracen-9-yl]-5-phenylpyrido[3,2-b]indole?
The IUPAC name of 7-[10-(4-fluoronaphthalen-1-yl)anthracen-9-yl]-5-phenylpyrido[3,2-b]indole (CID 88886589) is 7-[10-(4-fluoronaphthalen-1-yl)anthracen-9-yl]-5-phenylpyrido[3,2-b]indole.
What is the SMILES notation for 7-[10-(4-fluoronaphthalen-1-yl)anthracen-9-yl]-5-phenylpyrido[3,2-b]indole?
The canonical SMILES for 7-[10-(4-fluoronaphthalen-1-yl)anthracen-9-yl]-5-phenylpyrido[3,2-b]indole is Fc1ccc(-c2c3ccccc3c(-c3ccc4c5ncccc5n(-c5ccccc5)c4c3)c3ccccc23)c2ccccc12.
What is the InChIKey of 7-[10-(4-fluoronaphthalen-1-yl)anthracen-9-yl]-5-phenylpyrido[3,2-b]indole?
The InChIKey is QFZPRZHLYUFBQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H25FN2/c42-36-23-22-34(28-13-4-5-14-29(28)36)40-32-17-8-6-15-30(32)39(31-16-7-9-18-33(31)40)26-20-21-35-38(25-26)44(27-11-2-1-3-12-27)37-19-10-24-43-41(35)37/h1-25H.
What are the key properties of 7-[10-(4-fluoronaphthalen-1-yl)anthracen-9-yl]-5-phenylpyrido[3,2-b]indole?
7-[10-(4-fluoronaphthalen-1-yl)anthracen-9-yl]-5-phenylpyrido[3,2-b]indole has a molecular weight of 564.66 g/mol, XLogP of 11.11, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[10-(4-fluoronaphthalen-1-yl)anthracen-9-yl]-5-phenylpyrido[3,2-b]indole is sourced from PubChem (CID 88886589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).