4-chloro-2-(3-chlorophenyl)-5-(2-hydroxyethylamino)pyridazin-3-one

C12H11Cl2N3O2 — CID 2769271

IUPAC4-chloro-2-(3-chlorophenyl)-5-(2-hydroxyethylamino)pyridazin-3-one
SMILESO=c1c(Cl)c(NCCO)cnn1-c1cccc(Cl)c1
InChIInChI=1S/C12H11Cl2N3O2/c13-8-2-1-3-9(6-8)17-12(19)11(14)10(7-16-17)15-4-5-18/h1-3,6-7,15,18H,4-5H2
InChIKeyZGIUTBRFBQRNEN-UHFFFAOYSA-N
MW300.14 g/mol
LogP1.94
Rot. Bonds4

About 4-chloro-2-(3-chlorophenyl)-5-(2-hydroxyethylamino)pyridazin-3-one

4-chloro-2-(3-chlorophenyl)-5-(2-hydroxyethylamino)pyridazin-3-one (PubChem CID 2769271) has the molecular formula C12H11Cl2N3O2 and a molecular weight of 300.14 g/mol. Its IUPAC name is 4-chloro-2-(3-chlorophenyl)-5-(2-hydroxyethylamino)pyridazin-3-one.

Molecular Properties

Compound Name4-chloro-2-(3-chlorophenyl)-5-(2-hydroxyethylamino)pyridazin-3-one
PubChem CID2769271
Molecular FormulaC12H11Cl2N3O2
Molecular Weight300.14 g/mol
Exact Mass299.02
IUPAC Name4-chloro-2-(3-chlorophenyl)-5-(2-hydroxyethylamino)pyridazin-3-one
SMILESO=c1c(Cl)c(NCCO)cnn1-c1cccc(Cl)c1
InChIInChI=1S/C12H11Cl2N3O2/c13-8-2-1-3-9(6-8)17-12(19)11(14)10(7-16-17)15-4-5-18/h1-3,6-7,15,18H,4-5H2
InChIKeyZGIUTBRFBQRNEN-UHFFFAOYSA-N
XLogP1.94
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.14
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-chloro-2-(3-chlorophenyl)-5-(2-hydroxyethylamino)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-(3-chlorophenyl)-5-(2-hydroxyethylamino)pyridazin-3-one?
The IUPAC name of 4-chloro-2-(3-chlorophenyl)-5-(2-hydroxyethylamino)pyridazin-3-one (CID 2769271) is 4-chloro-2-(3-chlorophenyl)-5-(2-hydroxyethylamino)pyridazin-3-one.
What is the SMILES notation for 4-chloro-2-(3-chlorophenyl)-5-(2-hydroxyethylamino)pyridazin-3-one?
The canonical SMILES for 4-chloro-2-(3-chlorophenyl)-5-(2-hydroxyethylamino)pyridazin-3-one is O=c1c(Cl)c(NCCO)cnn1-c1cccc(Cl)c1.
What is the InChIKey of 4-chloro-2-(3-chlorophenyl)-5-(2-hydroxyethylamino)pyridazin-3-one?
The InChIKey is ZGIUTBRFBQRNEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11Cl2N3O2/c13-8-2-1-3-9(6-8)17-12(19)11(14)10(7-16-17)15-4-5-18/h1-3,6-7,15,18H,4-5H2.
What are the key properties of 4-chloro-2-(3-chlorophenyl)-5-(2-hydroxyethylamino)pyridazin-3-one?
4-chloro-2-(3-chlorophenyl)-5-(2-hydroxyethylamino)pyridazin-3-one has a molecular weight of 300.14 g/mol, XLogP of 1.94, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-(3-chlorophenyl)-5-(2-hydroxyethylamino)pyridazin-3-one is sourced from PubChem (CID 2769271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).