N-[(Z)-1-(2-chlorophenyl)ethylideneamino]-4-[(2Z)-2-[1-(2-chlorophenyl)ethylidene]hydrazinyl]benzamide;sulfuric acid

C23H22Cl2N4O5S — CID 75409654

IUPACN-[(Z)-1-(2-chlorophenyl)ethylideneamino]-4-[(2Z)-2-[1-(2-chlorophenyl)ethylidene]hydrazinyl]benzamide;sulfuric acid
SMILESC/C(=N/NC(=O)c1ccc(N/N=C(/C)c2ccccc2Cl)cc1)c1ccccc1Cl.O=S(=O)(O)O
InChIInChI=1S/C23H20Cl2N4O.H2O4S/c1-15(19-7-3-5-9-21(19)24)26-28-18-13-11-17(12-14-18)23(30)29-27-16(2)20-8-4-6-10-22(20)25;1-5(2,3)4/h3-14,28H,1-2H3,(H,29,30);(H2,1,2,3,4)/b26-15-,27-16-;
InChIKeySKLUATPQXFHQMD-MBDUUULYSA-N
MW537.43 g/mol
LogP5.33
Rot. Bonds6

About N-[(Z)-1-(2-chlorophenyl)ethylideneamino]-4-[(2Z)-2-[1-(2-chlorophenyl)ethylidene]hydrazinyl]benzamide;sulfuric acid

N-[(Z)-1-(2-chlorophenyl)ethylideneamino]-4-[(2Z)-2-[1-(2-chlorophenyl)ethylidene]hydrazinyl]benzamide;sulfuric acid (PubChem CID 75409654) has the molecular formula C23H22Cl2N4O5S and a molecular weight of 537.43 g/mol. Its IUPAC name is N-[(Z)-1-(2-chlorophenyl)ethylideneamino]-4-[(2Z)-2-[1-(2-chlorophenyl)ethylidene]hydrazinyl]benzamide;sulfuric acid.

Molecular Properties

Compound NameN-[(Z)-1-(2-chlorophenyl)ethylideneamino]-4-[(2Z)-2-[1-(2-chlorophenyl)ethylidene]hydrazinyl]benzamide;sulfuric acid
PubChem CID75409654
Molecular FormulaC23H22Cl2N4O5S
Molecular Weight537.43 g/mol
Exact Mass536.07
IUPAC NameN-[(Z)-1-(2-chlorophenyl)ethylideneamino]-4-[(2Z)-2-[1-(2-chlorophenyl)ethylidene]hydrazinyl]benzamide;sulfuric acid
SMILESC/C(=N/NC(=O)c1ccc(N/N=C(/C)c2ccccc2Cl)cc1)c1ccccc1Cl.O=S(=O)(O)O
InChIInChI=1S/C23H20Cl2N4O.H2O4S/c1-15(19-7-3-5-9-21(19)24)26-28-18-13-11-17(12-14-18)23(30)29-27-16(2)20-8-4-6-10-22(20)25;1-5(2,3)4/h3-14,28H,1-2H3,(H,29,30);(H2,1,2,3,4)/b26-15-,27-16-;
InChIKeySKLUATPQXFHQMD-MBDUUULYSA-N
XLogP5.33
TPSA140.45 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms35
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500537.43
LogP ≤ 55.33
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

Analyze N-[(Z)-1-(2-chlorophenyl)ethylideneamino]-4-[(2Z)-2-[1-(2-chlorophenyl)ethylidene]hydrazinyl]benzamide;sulfuric acid 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

N-[1-(2-chlorophenyl)ethylideneamino]-4-fluorobenzamide
CID 4123308
N-[(Z)-1-naphthalen-2-ylethylideneamino]-4-[(2Z)-2-(1-naphthalen-2-ylethylidene)hydrazinyl]benzamide;sulfuric acid
CID 75409659
N-[(E)-1-(4-methoxyphenyl)ethylideneamino]-4-[(2Z)-2-[1-(4-methoxyphenyl)ethylidene]hydrazinyl]benzamide;sulfuric acid
CID 75409663
4-bromo-N-[(E)-1-(2-chlorophenyl)ethylideneamino]aniline
CID 131740065
N-[1-(4-acetamidophenyl)ethylideneamino]-2-chlorobenzamide
CID 1225540
N-[1-(2-chlorophenyl)ethylideneamino]-3-fluorobenzamide
CID 4181605
3-bromo-N-[(Z)-1-(2-chlorophenyl)ethylideneamino]benzamide
CID 5332759
2-amino-N-[(Z)-1-(2-chlorophenyl)ethylideneamino]benzamide
CID 5332716
2-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide
CID 135688203
4-bromo-N-[1-(3-chloro-2-hydroxyphenyl)ethylideneamino]benzamide
CID 137139850
N-[1-(3-chloro-2-hydroxyphenyl)ethylideneamino]-4-methoxybenzamide
CID 137121413
2-chloro-N-[1-(2,3,4-trichlorophenyl)ethylideneamino]benzamide
CID 3997107

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-1-(2-chlorophenyl)ethylideneamino]-4-[(2Z)-2-[1-(2-chlorophenyl)ethylidene]hydrazinyl]benzamide;sulfuric acid?
The IUPAC name of N-[(Z)-1-(2-chlorophenyl)ethylideneamino]-4-[(2Z)-2-[1-(2-chlorophenyl)ethylidene]hydrazinyl]benzamide;sulfuric acid (CID 75409654) is N-[(Z)-1-(2-chlorophenyl)ethylideneamino]-4-[(2Z)-2-[1-(2-chlorophenyl)ethylidene]hydrazinyl]benzamide;sulfuric acid.
What is the SMILES notation for N-[(Z)-1-(2-chlorophenyl)ethylideneamino]-4-[(2Z)-2-[1-(2-chlorophenyl)ethylidene]hydrazinyl]benzamide;sulfuric acid?
The canonical SMILES for N-[(Z)-1-(2-chlorophenyl)ethylideneamino]-4-[(2Z)-2-[1-(2-chlorophenyl)ethylidene]hydrazinyl]benzamide;sulfuric acid is C/C(=N/NC(=O)c1ccc(N/N=C(/C)c2ccccc2Cl)cc1)c1ccccc1Cl.O=S(=O)(O)O.
What is the InChIKey of N-[(Z)-1-(2-chlorophenyl)ethylideneamino]-4-[(2Z)-2-[1-(2-chlorophenyl)ethylidene]hydrazinyl]benzamide;sulfuric acid?
The InChIKey is SKLUATPQXFHQMD-MBDUUULYSA-N. The full InChI is InChI=1S/C23H20Cl2N4O.H2O4S/c1-15(19-7-3-5-9-21(19)24)26-28-18-13-11-17(12-14-18)23(30)29-27-16(2)20-8-4-6-10-22(20)25;1-5(2,3)4/h3-14,28H,1-2H3,(H,29,30);(H2,1,2,3,4)/b26-15-,27-16-;.
What are the key properties of N-[(Z)-1-(2-chlorophenyl)ethylideneamino]-4-[(2Z)-2-[1-(2-chlorophenyl)ethylidene]hydrazinyl]benzamide;sulfuric acid?
N-[(Z)-1-(2-chlorophenyl)ethylideneamino]-4-[(2Z)-2-[1-(2-chlorophenyl)ethylidene]hydrazinyl]benzamide;sulfuric acid has a molecular weight of 537.43 g/mol, XLogP of 5.33, 6 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-1-(2-chlorophenyl)ethylideneamino]-4-[(2Z)-2-[1-(2-chlorophenyl)ethylidene]hydrazinyl]benzamide;sulfuric acid is sourced from PubChem (CID 75409654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).