CID 162321965

C23H20N2Na2 — CID 162321965

IUPAC—
SMILES[Na].[Na].c1ccc(Cc2nc(-c3ccccc3)[nH]c2Cc2ccccc2)cc1
InChIInChI=1S/C23H20N2.2Na/c1-4-10-18(11-5-1)16-21-22(17-19-12-6-2-7-13-19)25-23(24-21)20-14-8-3-9-15-20;;/h1-15H,16-17H2,(H,24,25);;
InChIKeyKJFLMZZHMZDBCO-UHFFFAOYSA-N
MW370.41 g/mol
LogP4.50
Rot. Bonds5

About CID 162321965

CID 162321965 (PubChem CID 162321965) has the molecular formula C23H20N2Na2 and a molecular weight of 370.41 g/mol.

Molecular Properties

Compound NameCID 162321965
PubChem CID162321965
Molecular FormulaC23H20N2Na2
Molecular Weight370.41 g/mol
Exact Mass370.14
IUPAC Name—
SMILES[Na].[Na].c1ccc(Cc2nc(-c3ccccc3)[nH]c2Cc2ccccc2)cc1
InChIInChI=1S/C23H20N2.2Na/c1-4-10-18(11-5-1)16-21-22(17-19-12-6-2-7-13-19)25-23(24-21)20-14-8-3-9-15-20;;/h1-15H,16-17H2,(H,24,25);;
InChIKeyKJFLMZZHMZDBCO-UHFFFAOYSA-N
XLogP4.50
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.41
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 162321965?
The IUPAC name of CID 162321965 (CID 162321965) is not available.
What is the SMILES notation for CID 162321965?
The canonical SMILES for CID 162321965 is [Na].[Na].c1ccc(Cc2nc(-c3ccccc3)[nH]c2Cc2ccccc2)cc1.
What is the InChIKey of CID 162321965?
The InChIKey is KJFLMZZHMZDBCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2.2Na/c1-4-10-18(11-5-1)16-21-22(17-19-12-6-2-7-13-19)25-23(24-21)20-14-8-3-9-15-20;;/h1-15H,16-17H2,(H,24,25);;.
What are the key properties of CID 162321965?
CID 162321965 has a molecular weight of 370.41 g/mol, XLogP of 4.50, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 162321965 is sourced from PubChem (CID 162321965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).