4-[(Z)-N-[(Z)-[(4-aminophenyl)-phenylmethylidene]amino]-C-phenylcarbonimidoyl]aniline

C26H22N4 — CID 6871279

IUPAC4-[(Z)-N-[(Z)-[(4-aminophenyl)-phenylmethylidene]amino]-C-phenylcarbonimidoyl]aniline
SMILESNc1ccc(/C(=N\N=C(\c2ccccc2)c2ccc(N)cc2)c2ccccc2)cc1
InChIInChI=1S/C26H22N4/c27-23-15-11-21(12-16-23)25(19-7-3-1-4-8-19)29-30-26(20-9-5-2-6-10-20)22-13-17-24(28)18-14-22/h1-18H,27-28H2/b29-25-,30-26-
InChIKeyKUZMMZJVOVUSFZ-IDDWGTJGSA-N
MW390.49 g/mol
LogP5.14
Rot. Bonds5

About 4-[(Z)-N-[(Z)-[(4-aminophenyl)-phenylmethylidene]amino]-C-phenylcarbonimidoyl]aniline

4-[(Z)-N-[(Z)-[(4-aminophenyl)-phenylmethylidene]amino]-C-phenylcarbonimidoyl]aniline (PubChem CID 6871279) has the molecular formula C26H22N4 and a molecular weight of 390.49 g/mol. Its IUPAC name is 4-[(Z)-N-[(Z)-[(4-aminophenyl)-phenylmethylidene]amino]-C-phenylcarbonimidoyl]aniline.

Molecular Properties

Compound Name4-[(Z)-N-[(Z)-[(4-aminophenyl)-phenylmethylidene]amino]-C-phenylcarbonimidoyl]aniline
PubChem CID6871279
Molecular FormulaC26H22N4
Molecular Weight390.49 g/mol
Exact Mass390.18
IUPAC Name4-[(Z)-N-[(Z)-[(4-aminophenyl)-phenylmethylidene]amino]-C-phenylcarbonimidoyl]aniline
SMILESNc1ccc(/C(=N\N=C(\c2ccccc2)c2ccc(N)cc2)c2ccccc2)cc1
InChIInChI=1S/C26H22N4/c27-23-15-11-21(12-16-23)25(19-7-3-1-4-8-19)29-30-26(20-9-5-2-6-10-20)22-13-17-24(28)18-14-22/h1-18H,27-28H2/b29-25-,30-26-
InChIKeyKUZMMZJVOVUSFZ-IDDWGTJGSA-N
XLogP5.14
TPSA76.76 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500390.49
LogP ≤ 55.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 4-[(Z)-N-[(Z)-[(4-aminophenyl)-phenylmethylidene]amino]-C-phenylcarbonimidoyl]aniline 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-[(Z)-N-[(Z)-[(4-aminophenyl)-phenylmethylidene]amino]-C-phenylcarbonimidoyl]aniline?
The IUPAC name of 4-[(Z)-N-[(Z)-[(4-aminophenyl)-phenylmethylidene]amino]-C-phenylcarbonimidoyl]aniline (CID 6871279) is 4-[(Z)-N-[(Z)-[(4-aminophenyl)-phenylmethylidene]amino]-C-phenylcarbonimidoyl]aniline.
What is the SMILES notation for 4-[(Z)-N-[(Z)-[(4-aminophenyl)-phenylmethylidene]amino]-C-phenylcarbonimidoyl]aniline?
The canonical SMILES for 4-[(Z)-N-[(Z)-[(4-aminophenyl)-phenylmethylidene]amino]-C-phenylcarbonimidoyl]aniline is Nc1ccc(/C(=N\N=C(\c2ccccc2)c2ccc(N)cc2)c2ccccc2)cc1.
What is the InChIKey of 4-[(Z)-N-[(Z)-[(4-aminophenyl)-phenylmethylidene]amino]-C-phenylcarbonimidoyl]aniline?
The InChIKey is KUZMMZJVOVUSFZ-IDDWGTJGSA-N. The full InChI is InChI=1S/C26H22N4/c27-23-15-11-21(12-16-23)25(19-7-3-1-4-8-19)29-30-26(20-9-5-2-6-10-20)22-13-17-24(28)18-14-22/h1-18H,27-28H2/b29-25-,30-26-.
What are the key properties of 4-[(Z)-N-[(Z)-[(4-aminophenyl)-phenylmethylidene]amino]-C-phenylcarbonimidoyl]aniline?
4-[(Z)-N-[(Z)-[(4-aminophenyl)-phenylmethylidene]amino]-C-phenylcarbonimidoyl]aniline has a molecular weight of 390.49 g/mol, XLogP of 5.14, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(Z)-N-[(Z)-[(4-aminophenyl)-phenylmethylidene]amino]-C-phenylcarbonimidoyl]aniline is sourced from PubChem (CID 6871279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).