CID 163893418

C25H15Al2N — CID 163893418

IUPAC—
SMILES[Al]C1c2ccccc2-c2cc(-c3ccc4c(c3)c3ccccc3n4[Al])ccc21
InChIInChI=1S/C25H15N.2Al/c1-2-6-20-18(5-1)13-19-10-9-16(14-22(19)20)17-11-12-25-23(15-17)21-7-3-4-8-24(21)26-25;;/h1-15H;;/q-1;;+1
InChIKeyMNBKHGHBAYNPJG-UHFFFAOYSA-N
MW383.37 g/mol
LogP5.63
Rot. Bonds1

About CID 163893418

CID 163893418 (PubChem CID 163893418) has the molecular formula C25H15Al2N and a molecular weight of 383.37 g/mol.

Molecular Properties

Compound NameCID 163893418
PubChem CID163893418
Molecular FormulaC25H15Al2N
Molecular Weight383.37 g/mol
Exact Mass383.08
IUPAC Name—
SMILES[Al]C1c2ccccc2-c2cc(-c3ccc4c(c3)c3ccccc3n4[Al])ccc21
InChIInChI=1S/C25H15N.2Al/c1-2-6-20-18(5-1)13-19-10-9-16(14-22(19)20)17-11-12-25-23(15-17)21-7-3-4-8-24(21)26-25;;/h1-15H;;/q-1;;+1
InChIKeyMNBKHGHBAYNPJG-UHFFFAOYSA-N
XLogP5.63
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500383.37
LogP ≤ 55.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

9-phenyl-3-[3-(9-phenylcarbazol-3-yl)-9H-fluoren-9-yl]carbazole
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3-(9-phenyl-9H-fluoren-3-yl)-9-(4-phenylphenyl)carbazole
CID 170253658
3-[9-[3-(4-carbazol-9-ylphenyl)phenyl]-9H-fluoren-3-yl]-9-phenylcarbazole
CID 170060039
9-(2-phenylphenyl)-3-[3-[9-(2-phenylphenyl)-9H-fluoren-3-yl]carbazol-9-yl]carbazole
CID 71232640
3-[4-[(9R)-3-(3-carbazol-9-ylphenyl)-9H-fluoren-9-yl]phenyl]-9-(4-phenylphenyl)carbazole
CID 170074676
9-phenyl-3-[6-(9-phenylcarbazol-3-yl)-9-pyridin-1-ium-1-yl-9H-fluoren-3-yl]carbazole
CID 123866842
9-dibenzothiophen-4-yl-3-(9-phenyl-9H-fluoren-3-yl)carbazole
CID 126755928
3-[4-(9H-fluoren-9-yl)phenyl]-9-[4-[9-[(4-phenylphenyl)methyl]-9H-fluoren-3-yl]phenyl]carbazole
CID 170064226
CID 147627416
CID 147627416
3-[9-(3-dibenzofuran-2-ylphenyl)-9H-fluoren-3-yl]-9-phenylcarbazole
CID 126753873
2-methyl-3-[3-[9-(3-phenylphenyl)-9H-fluoren-3-yl]carbazol-9-yl]benzenethiol
CID 170132483
3-(9-dibenzofuran-2-yl-9H-fluoren-3-yl)-9-(3-dibenzofuran-2-ylphenyl)carbazole
CID 163643866

Frequently Asked Questions

What is the IUPAC name of CID 163893418?
The IUPAC name of CID 163893418 (CID 163893418) is not available.
What is the SMILES notation for CID 163893418?
The canonical SMILES for CID 163893418 is [Al]C1c2ccccc2-c2cc(-c3ccc4c(c3)c3ccccc3n4[Al])ccc21.
What is the InChIKey of CID 163893418?
The InChIKey is MNBKHGHBAYNPJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H15N.2Al/c1-2-6-20-18(5-1)13-19-10-9-16(14-22(19)20)17-11-12-25-23(15-17)21-7-3-4-8-24(21)26-25;;/h1-15H;;/q-1;;+1.
What are the key properties of CID 163893418?
CID 163893418 has a molecular weight of 383.37 g/mol, XLogP of 5.63, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 163893418 is sourced from PubChem (CID 163893418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).