3,6-difluoro-10-phenylacridin-9-one

C19H11F2NO — CID 156785373

IUPAC3,6-difluoro-10-phenylacridin-9-one
SMILESO=c1c2ccc(F)cc2n(-c2ccccc2)c2cc(F)ccc12
InChIInChI=1S/C19H11F2NO/c20-12-6-8-15-17(10-12)22(14-4-2-1-3-5-14)18-11-13(21)7-9-16(18)19(15)23/h1-11H
InChIKeyCIXBPRMAZYBBKT-UHFFFAOYSA-N
MW307.30 g/mol
LogP4.42
Rot. Bonds1

About 3,6-difluoro-10-phenylacridin-9-one

3,6-difluoro-10-phenylacridin-9-one (PubChem CID 156785373) has the molecular formula C19H11F2NO and a molecular weight of 307.30 g/mol. Its IUPAC name is 3,6-difluoro-10-phenylacridin-9-one.

Molecular Properties

Compound Name3,6-difluoro-10-phenylacridin-9-one
PubChem CID156785373
Molecular FormulaC19H11F2NO
Molecular Weight307.30 g/mol
Exact Mass307.08
IUPAC Name3,6-difluoro-10-phenylacridin-9-one
SMILESO=c1c2ccc(F)cc2n(-c2ccccc2)c2cc(F)ccc12
InChIInChI=1S/C19H11F2NO/c20-12-6-8-15-17(10-12)22(14-4-2-1-3-5-14)18-11-13(21)7-9-16(18)19(15)23/h1-11H
InChIKeyCIXBPRMAZYBBKT-UHFFFAOYSA-N
XLogP4.42
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.30
LogP ≤ 54.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3,6-difluoro-10-phenylacridin-9-one?
The IUPAC name of 3,6-difluoro-10-phenylacridin-9-one (CID 156785373) is 3,6-difluoro-10-phenylacridin-9-one.
What is the SMILES notation for 3,6-difluoro-10-phenylacridin-9-one?
The canonical SMILES for 3,6-difluoro-10-phenylacridin-9-one is O=c1c2ccc(F)cc2n(-c2ccccc2)c2cc(F)ccc12.
What is the InChIKey of 3,6-difluoro-10-phenylacridin-9-one?
The InChIKey is CIXBPRMAZYBBKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H11F2NO/c20-12-6-8-15-17(10-12)22(14-4-2-1-3-5-14)18-11-13(21)7-9-16(18)19(15)23/h1-11H.
What are the key properties of 3,6-difluoro-10-phenylacridin-9-one?
3,6-difluoro-10-phenylacridin-9-one has a molecular weight of 307.30 g/mol, XLogP of 4.42, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-difluoro-10-phenylacridin-9-one is sourced from PubChem (CID 156785373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).