4-chloro-2-(4-chlorophenyl)-5-[(4-chlorophenyl)methoxy]pyridazin-3-one

C17H11Cl3N2O2 — CID 3065230

IUPAC4-chloro-2-(4-chlorophenyl)-5-[(4-chlorophenyl)methoxy]pyridazin-3-one
SMILESO=c1c(Cl)c(OCc2ccc(Cl)cc2)cnn1-c1ccc(Cl)cc1
InChIInChI=1S/C17H11Cl3N2O2/c18-12-3-1-11(2-4-12)10-24-15-9-21-22(17(23)16(15)20)14-7-5-13(19)6-8-14/h1-9H,10H2
InChIKeyLXFYHXTXYGAIOJ-UHFFFAOYSA-N
MW381.65 g/mol
LogP4.77
Rot. Bonds4

About 4-chloro-2-(4-chlorophenyl)-5-[(4-chlorophenyl)methoxy]pyridazin-3-one

4-chloro-2-(4-chlorophenyl)-5-[(4-chlorophenyl)methoxy]pyridazin-3-one (PubChem CID 3065230) has the molecular formula C17H11Cl3N2O2 and a molecular weight of 381.65 g/mol. Its IUPAC name is 4-chloro-2-(4-chlorophenyl)-5-[(4-chlorophenyl)methoxy]pyridazin-3-one.

Molecular Properties

Compound Name4-chloro-2-(4-chlorophenyl)-5-[(4-chlorophenyl)methoxy]pyridazin-3-one
PubChem CID3065230
Molecular FormulaC17H11Cl3N2O2
Molecular Weight381.65 g/mol
Exact Mass379.99
IUPAC Name4-chloro-2-(4-chlorophenyl)-5-[(4-chlorophenyl)methoxy]pyridazin-3-one
SMILESO=c1c(Cl)c(OCc2ccc(Cl)cc2)cnn1-c1ccc(Cl)cc1
InChIInChI=1S/C17H11Cl3N2O2/c18-12-3-1-11(2-4-12)10-24-15-9-21-22(17(23)16(15)20)14-7-5-13(19)6-8-14/h1-9H,10H2
InChIKeyLXFYHXTXYGAIOJ-UHFFFAOYSA-N
XLogP4.77
TPSA44.12 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.65
LogP ≤ 54.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-chloro-2-(4-chlorophenyl)-5-[(4-chlorophenyl)methoxy]pyridazin-3-one 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-chloro-2-(4-chlorophenyl)-5-[(4-chlorophenyl)methoxy]pyridazin-3-one?
The IUPAC name of 4-chloro-2-(4-chlorophenyl)-5-[(4-chlorophenyl)methoxy]pyridazin-3-one (CID 3065230) is 4-chloro-2-(4-chlorophenyl)-5-[(4-chlorophenyl)methoxy]pyridazin-3-one.
What is the SMILES notation for 4-chloro-2-(4-chlorophenyl)-5-[(4-chlorophenyl)methoxy]pyridazin-3-one?
The canonical SMILES for 4-chloro-2-(4-chlorophenyl)-5-[(4-chlorophenyl)methoxy]pyridazin-3-one is O=c1c(Cl)c(OCc2ccc(Cl)cc2)cnn1-c1ccc(Cl)cc1.
What is the InChIKey of 4-chloro-2-(4-chlorophenyl)-5-[(4-chlorophenyl)methoxy]pyridazin-3-one?
The InChIKey is LXFYHXTXYGAIOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11Cl3N2O2/c18-12-3-1-11(2-4-12)10-24-15-9-21-22(17(23)16(15)20)14-7-5-13(19)6-8-14/h1-9H,10H2.
What are the key properties of 4-chloro-2-(4-chlorophenyl)-5-[(4-chlorophenyl)methoxy]pyridazin-3-one?
4-chloro-2-(4-chlorophenyl)-5-[(4-chlorophenyl)methoxy]pyridazin-3-one has a molecular weight of 381.65 g/mol, XLogP of 4.77, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-(4-chlorophenyl)-5-[(4-chlorophenyl)methoxy]pyridazin-3-one is sourced from PubChem (CID 3065230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).