bis(N-(4-chlorophenyl)chromen-2-imine);nickel

C30H20Cl2N2NiO2 — CID 6517634

IUPACbis(N-(4-chlorophenyl)chromen-2-imine);nickel
SMILESClc1ccc(/N=c2\ccc3ccccc3o2)cc1.Clc1ccc(/N=c2\ccc3ccccc3o2)cc1.[Ni]
InChIInChI=1S/2C15H10ClNO.Ni/c2*16-12-6-8-13(9-7-12)17-15-10-5-11-3-1-2-4-14(11)18-15;/h2*1-10H;/b2*17-15+;
InChIKeyIGDXKZANUDLSOW-RVUOTHGYSA-N
MW570.10 g/mol
LogP8.63
Rot. Bonds2

About bis(N-(4-chlorophenyl)chromen-2-imine);nickel

bis(N-(4-chlorophenyl)chromen-2-imine);nickel (PubChem CID 6517634) has the molecular formula C30H20Cl2N2NiO2 and a molecular weight of 570.10 g/mol. Its IUPAC name is bis(N-(4-chlorophenyl)chromen-2-imine);nickel.

Molecular Properties

Compound Namebis(N-(4-chlorophenyl)chromen-2-imine);nickel
PubChem CID6517634
Molecular FormulaC30H20Cl2N2NiO2
Molecular Weight570.10 g/mol
Exact Mass568.03
IUPAC Namebis(N-(4-chlorophenyl)chromen-2-imine);nickel
SMILESClc1ccc(/N=c2\ccc3ccccc3o2)cc1.Clc1ccc(/N=c2\ccc3ccccc3o2)cc1.[Ni]
InChIInChI=1S/2C15H10ClNO.Ni/c2*16-12-6-8-13(9-7-12)17-15-10-5-11-3-1-2-4-14(11)18-15;/h2*1-10H;/b2*17-15+;
InChIKeyIGDXKZANUDLSOW-RVUOTHGYSA-N
XLogP8.63
TPSA51.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500570.10
LogP ≤ 58.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze bis(N-(4-chlorophenyl)chromen-2-imine);nickel with MolForge

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

Launch Full Analysis

Related Compounds

bis((4-chlorophenyl)-chromen-2-ylideneazanium);nickel
CID 50896907
3-(4-chlorophenyl)-2-(4-chlorophenyl)imino-1,3-benzoxazin-4-one
CID 10500149
1-benzofuran;1-chloro-4-phenylbenzene
CID 175596576
1-benzofuran-2-yl-(4-chlorophenyl)methanamine
CID 13048639
chromen-2-one;copper
CID 175033656
2-[3-(4-chlorophenyl)phenyl]-1-benzofuran
CID 170402405
3-[(4-chlorophenyl)methylideneamino]chromen-2-one
CID 15930944
benzene;chlorobenzene
CID 159657667
2-[4-[(E)-2-(4-chlorophenyl)ethenyl]phenyl]-1-benzofuran
CID 88836846
N-(4-chlorophenyl)-2-(3,4-dimethylphenyl)iminochromene-3-carboxamide
CID 51367283
[1,3-benzoxazol-2-yl(difluoro)methyl]-(4-chlorophenyl)diazene
CID 141476146
N,3-diphenylchromen-2-imine
CID 135029902

Frequently Asked Questions

What is the IUPAC name of bis(N-(4-chlorophenyl)chromen-2-imine);nickel?
The IUPAC name of bis(N-(4-chlorophenyl)chromen-2-imine);nickel (CID 6517634) is bis(N-(4-chlorophenyl)chromen-2-imine);nickel.
What is the SMILES notation for bis(N-(4-chlorophenyl)chromen-2-imine);nickel?
The canonical SMILES for bis(N-(4-chlorophenyl)chromen-2-imine);nickel is Clc1ccc(/N=c2\ccc3ccccc3o2)cc1.Clc1ccc(/N=c2\ccc3ccccc3o2)cc1.[Ni].
What is the InChIKey of bis(N-(4-chlorophenyl)chromen-2-imine);nickel?
The InChIKey is IGDXKZANUDLSOW-RVUOTHGYSA-N. The full InChI is InChI=1S/2C15H10ClNO.Ni/c2*16-12-6-8-13(9-7-12)17-15-10-5-11-3-1-2-4-14(11)18-15;/h2*1-10H;/b2*17-15+;.
What are the key properties of bis(N-(4-chlorophenyl)chromen-2-imine);nickel?
bis(N-(4-chlorophenyl)chromen-2-imine);nickel has a molecular weight of 570.10 g/mol, XLogP of 8.63, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(N-(4-chlorophenyl)chromen-2-imine);nickel is sourced from PubChem (CID 6517634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).