(4-methylphenyl)-[4-(4-methylphenyl)azanidylphenyl]azanide;bis(yttrium)

C20H18N2Y2-2 — CID 140602040

IUPAC(4-methylphenyl)-[4-(4-methylphenyl)azanidylphenyl]azanide;bis(yttrium)
SMILESCc1ccc([N-]c2ccc([N-]c3ccc(C)cc3)cc2)cc1.[Y].[Y]
InChIInChI=1S/C20H18N2.2Y/c1-15-3-7-17(8-4-15)21-19-11-13-20(14-12-19)22-18-9-5-16(2)6-10-18;;/h3-14H,1-2H3;;/q-2;;
InChIKeyHHWZQIHDUKPDTD-UHFFFAOYSA-N
MW464.19 g/mol
LogP6.97
Rot. Bonds4

About (4-methylphenyl)-[4-(4-methylphenyl)azanidylphenyl]azanide;bis(yttrium)

(4-methylphenyl)-[4-(4-methylphenyl)azanidylphenyl]azanide;bis(yttrium) (PubChem CID 140602040) has the molecular formula C20H18N2Y2-2 and a molecular weight of 464.19 g/mol. Its IUPAC name is (4-methylphenyl)-[4-(4-methylphenyl)azanidylphenyl]azanide;bis(yttrium).

Molecular Properties

Compound Name(4-methylphenyl)-[4-(4-methylphenyl)azanidylphenyl]azanide;bis(yttrium)
PubChem CID140602040
Molecular FormulaC20H18N2Y2-2
Molecular Weight464.19 g/mol
Exact Mass463.96
IUPAC Name(4-methylphenyl)-[4-(4-methylphenyl)azanidylphenyl]azanide;bis(yttrium)
SMILESCc1ccc([N-]c2ccc([N-]c3ccc(C)cc3)cc2)cc1.[Y].[Y]
InChIInChI=1S/C20H18N2.2Y/c1-15-3-7-17(8-4-15)21-19-11-13-20(14-12-19)22-18-9-5-16(2)6-10-18;;/h3-14H,1-2H3;;/q-2;;
InChIKeyHHWZQIHDUKPDTD-UHFFFAOYSA-N
XLogP6.97
TPSA28.20 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500464.19
LogP ≤ 56.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze (4-methylphenyl)-[4-(4-methylphenyl)azanidylphenyl]azanide;bis(yttrium) with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (4-methylphenyl)-[4-(4-methylphenyl)azanidylphenyl]azanide;bis(yttrium)?
The IUPAC name of (4-methylphenyl)-[4-(4-methylphenyl)azanidylphenyl]azanide;bis(yttrium) (CID 140602040) is (4-methylphenyl)-[4-(4-methylphenyl)azanidylphenyl]azanide;bis(yttrium).
What is the SMILES notation for (4-methylphenyl)-[4-(4-methylphenyl)azanidylphenyl]azanide;bis(yttrium)?
The canonical SMILES for (4-methylphenyl)-[4-(4-methylphenyl)azanidylphenyl]azanide;bis(yttrium) is Cc1ccc([N-]c2ccc([N-]c3ccc(C)cc3)cc2)cc1.[Y].[Y].
What is the InChIKey of (4-methylphenyl)-[4-(4-methylphenyl)azanidylphenyl]azanide;bis(yttrium)?
The InChIKey is HHWZQIHDUKPDTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2.2Y/c1-15-3-7-17(8-4-15)21-19-11-13-20(14-12-19)22-18-9-5-16(2)6-10-18;;/h3-14H,1-2H3;;/q-2;;.
What are the key properties of (4-methylphenyl)-[4-(4-methylphenyl)azanidylphenyl]azanide;bis(yttrium)?
(4-methylphenyl)-[4-(4-methylphenyl)azanidylphenyl]azanide;bis(yttrium) has a molecular weight of 464.19 g/mol, XLogP of 6.97, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylphenyl)-[4-(4-methylphenyl)azanidylphenyl]azanide;bis(yttrium) is sourced from PubChem (CID 140602040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).