4-chloro-6-(4-chlorophenyl)sulfanyl-3-phenylpyridazine

C16H10Cl2N2S — CID 6404752

IUPAC4-chloro-6-(4-chlorophenyl)sulfanyl-3-phenylpyridazine
SMILESClc1ccc(Sc2cc(Cl)c(-c3ccccc3)nn2)cc1
InChIInChI=1S/C16H10Cl2N2S/c17-12-6-8-13(9-7-12)21-15-10-14(18)16(20-19-15)11-4-2-1-3-5-11/h1-10H
InChIKeyGWYYCGQQCOOEHB-UHFFFAOYSA-N
MW333.24 g/mol
LogP5.60
Rot. Bonds3

About 4-chloro-6-(4-chlorophenyl)sulfanyl-3-phenylpyridazine

4-chloro-6-(4-chlorophenyl)sulfanyl-3-phenylpyridazine (PubChem CID 6404752) has the molecular formula C16H10Cl2N2S and a molecular weight of 333.24 g/mol. Its IUPAC name is 4-chloro-6-(4-chlorophenyl)sulfanyl-3-phenylpyridazine.

Molecular Properties

Compound Name4-chloro-6-(4-chlorophenyl)sulfanyl-3-phenylpyridazine
PubChem CID6404752
Molecular FormulaC16H10Cl2N2S
Molecular Weight333.24 g/mol
Exact Mass331.99
IUPAC Name4-chloro-6-(4-chlorophenyl)sulfanyl-3-phenylpyridazine
SMILESClc1ccc(Sc2cc(Cl)c(-c3ccccc3)nn2)cc1
InChIInChI=1S/C16H10Cl2N2S/c17-12-6-8-13(9-7-12)21-15-10-14(18)16(20-19-15)11-4-2-1-3-5-11/h1-10H
InChIKeyGWYYCGQQCOOEHB-UHFFFAOYSA-N
XLogP5.60
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500333.24
LogP ≤ 55.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-chloro-6-(4-chlorophenyl)sulfanyl-3-phenylpyridazine 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-6-(4-chlorophenyl)sulfanyl-3-phenylpyridazine?
The IUPAC name of 4-chloro-6-(4-chlorophenyl)sulfanyl-3-phenylpyridazine (CID 6404752) is 4-chloro-6-(4-chlorophenyl)sulfanyl-3-phenylpyridazine.
What is the SMILES notation for 4-chloro-6-(4-chlorophenyl)sulfanyl-3-phenylpyridazine?
The canonical SMILES for 4-chloro-6-(4-chlorophenyl)sulfanyl-3-phenylpyridazine is Clc1ccc(Sc2cc(Cl)c(-c3ccccc3)nn2)cc1.
What is the InChIKey of 4-chloro-6-(4-chlorophenyl)sulfanyl-3-phenylpyridazine?
The InChIKey is GWYYCGQQCOOEHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10Cl2N2S/c17-12-6-8-13(9-7-12)21-15-10-14(18)16(20-19-15)11-4-2-1-3-5-11/h1-10H.
What are the key properties of 4-chloro-6-(4-chlorophenyl)sulfanyl-3-phenylpyridazine?
4-chloro-6-(4-chlorophenyl)sulfanyl-3-phenylpyridazine has a molecular weight of 333.24 g/mol, XLogP of 5.60, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-(4-chlorophenyl)sulfanyl-3-phenylpyridazine is sourced from PubChem (CID 6404752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).