9-fluoro-10-[3-(9-fluoro-9-methylacridin-10-yl)phenyl]-9-methylacridine

C34H26F2N2 — CID 59399643

IUPAC9-fluoro-10-[3-(9-fluoro-9-methylacridin-10-yl)phenyl]-9-methylacridine
SMILESCC1(F)c2ccccc2N(c2cccc(N3c4ccccc4C(C)(F)c4ccccc43)c2)c2ccccc21
InChIInChI=1S/C34H26F2N2/c1-33(35)25-14-3-7-18-29(25)37(30-19-8-4-15-26(30)33)23-12-11-13-24(22-23)38-31-20-9-5-16-27(31)34(2,36)28-17-6-10-21-32(28)38/h3-22H,1-2H3
InChIKeyJUEQBMLIWFWQRM-UHFFFAOYSA-N
MW500.59 g/mol
LogP9.72
Rot. Bonds2

About 9-fluoro-10-[3-(9-fluoro-9-methylacridin-10-yl)phenyl]-9-methylacridine

9-fluoro-10-[3-(9-fluoro-9-methylacridin-10-yl)phenyl]-9-methylacridine (PubChem CID 59399643) has the molecular formula C34H26F2N2 and a molecular weight of 500.59 g/mol. Its IUPAC name is 9-fluoro-10-[3-(9-fluoro-9-methylacridin-10-yl)phenyl]-9-methylacridine.

Molecular Properties

Compound Name9-fluoro-10-[3-(9-fluoro-9-methylacridin-10-yl)phenyl]-9-methylacridine
PubChem CID59399643
Molecular FormulaC34H26F2N2
Molecular Weight500.59 g/mol
Exact Mass500.21
IUPAC Name9-fluoro-10-[3-(9-fluoro-9-methylacridin-10-yl)phenyl]-9-methylacridine
SMILESCC1(F)c2ccccc2N(c2cccc(N3c4ccccc4C(C)(F)c4ccccc43)c2)c2ccccc21
InChIInChI=1S/C34H26F2N2/c1-33(35)25-14-3-7-18-29(25)37(30-19-8-4-15-26(30)33)23-12-11-13-24(22-23)38-31-20-9-5-16-27(31)34(2,36)28-17-6-10-21-32(28)38/h3-22H,1-2H3
InChIKeyJUEQBMLIWFWQRM-UHFFFAOYSA-N
XLogP9.72
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms38
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500500.59
LogP ≤ 59.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-fluoro-10-[3-(9-fluoro-9-methylacridin-10-yl)phenyl]-9-methylacridine?
The IUPAC name of 9-fluoro-10-[3-(9-fluoro-9-methylacridin-10-yl)phenyl]-9-methylacridine (CID 59399643) is 9-fluoro-10-[3-(9-fluoro-9-methylacridin-10-yl)phenyl]-9-methylacridine.
What is the SMILES notation for 9-fluoro-10-[3-(9-fluoro-9-methylacridin-10-yl)phenyl]-9-methylacridine?
The canonical SMILES for 9-fluoro-10-[3-(9-fluoro-9-methylacridin-10-yl)phenyl]-9-methylacridine is CC1(F)c2ccccc2N(c2cccc(N3c4ccccc4C(C)(F)c4ccccc43)c2)c2ccccc21.
What is the InChIKey of 9-fluoro-10-[3-(9-fluoro-9-methylacridin-10-yl)phenyl]-9-methylacridine?
The InChIKey is JUEQBMLIWFWQRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H26F2N2/c1-33(35)25-14-3-7-18-29(25)37(30-19-8-4-15-26(30)33)23-12-11-13-24(22-23)38-31-20-9-5-16-27(31)34(2,36)28-17-6-10-21-32(28)38/h3-22H,1-2H3.
What are the key properties of 9-fluoro-10-[3-(9-fluoro-9-methylacridin-10-yl)phenyl]-9-methylacridine?
9-fluoro-10-[3-(9-fluoro-9-methylacridin-10-yl)phenyl]-9-methylacridine has a molecular weight of 500.59 g/mol, XLogP of 9.72, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-fluoro-10-[3-(9-fluoro-9-methylacridin-10-yl)phenyl]-9-methylacridine is sourced from PubChem (CID 59399643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).