3,6-dichloro-N-(2,4-dichlorophenyl)pyridazine-4-carboxamide

C11H5Cl4N3O — CID 13456235

IUPAC3,6-dichloro-N-(2,4-dichlorophenyl)pyridazine-4-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1Cl)c1cc(Cl)nnc1Cl
InChIInChI=1S/C11H5Cl4N3O/c12-5-1-2-8(7(13)3-5)16-11(19)6-4-9(14)17-18-10(6)15/h1-4H,(H,16,19)
InChIKeyPARRBRLXALXTJE-UHFFFAOYSA-N
MW336.99 g/mol
LogP4.34
Rot. Bonds2

About 3,6-dichloro-N-(2,4-dichlorophenyl)pyridazine-4-carboxamide

3,6-dichloro-N-(2,4-dichlorophenyl)pyridazine-4-carboxamide (PubChem CID 13456235) has the molecular formula C11H5Cl4N3O and a molecular weight of 336.99 g/mol. Its IUPAC name is 3,6-dichloro-N-(2,4-dichlorophenyl)pyridazine-4-carboxamide.

Molecular Properties

Compound Name3,6-dichloro-N-(2,4-dichlorophenyl)pyridazine-4-carboxamide
PubChem CID13456235
Molecular FormulaC11H5Cl4N3O
Molecular Weight336.99 g/mol
Exact Mass334.92
IUPAC Name3,6-dichloro-N-(2,4-dichlorophenyl)pyridazine-4-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1Cl)c1cc(Cl)nnc1Cl
InChIInChI=1S/C11H5Cl4N3O/c12-5-1-2-8(7(13)3-5)16-11(19)6-4-9(14)17-18-10(6)15/h1-4H,(H,16,19)
InChIKeyPARRBRLXALXTJE-UHFFFAOYSA-N
XLogP4.34
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.99
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,6-dichloro-N-(3,6-dichloropyridazin-4-yl)pyridazine-4-carboxamide
CID 87380086
2,4-diamino-N-(2,4-dichlorophenyl)benzamide
CID 61091411
N-(2-bromo-3-chlorophenyl)-3,6-dichloropyridazine-4-carboxamide
CID 114038582
2,4-dichloro-N-(2,4-diaminophenyl)benzamide
CID 3289915
N-(2,4-dichlorophenyl)-2-[2-[(2,4-dichlorophenyl)carbamoyl]phenyl]benzamide
CID 5150334
3,6-dichloro-N-(2-methylsulfanylphenyl)pyridazine-4-carboxamide
CID 103606441
2-[(2,4-dichlorophenyl)carbamoyl]benzoic acid
CID 3883439
2-amino-N-(2,4-dichlorophenyl)-5-hydroxybenzamide
CID 107073840
N-(4-bromophenyl)-3,6-dichloropyridazine-4-carboxamide
CID 13456211
N-(2,4-dichlorophenyl)-2-[[2-[(2,4-dichlorophenyl)carbamoyl]phenyl]disulfanyl]benzamide
CID 6483556
5-chloro-N-(2-chloro-4-iodophenyl)-2-hydrazinylbenzamide
CID 107606119
2-bromo-N-(2,4-dichlorophenyl)pyridine-3-carboxamide
CID 113255485

Frequently Asked Questions

What is the IUPAC name of 3,6-dichloro-N-(2,4-dichlorophenyl)pyridazine-4-carboxamide?
The IUPAC name of 3,6-dichloro-N-(2,4-dichlorophenyl)pyridazine-4-carboxamide (CID 13456235) is 3,6-dichloro-N-(2,4-dichlorophenyl)pyridazine-4-carboxamide.
What is the SMILES notation for 3,6-dichloro-N-(2,4-dichlorophenyl)pyridazine-4-carboxamide?
The canonical SMILES for 3,6-dichloro-N-(2,4-dichlorophenyl)pyridazine-4-carboxamide is O=C(Nc1ccc(Cl)cc1Cl)c1cc(Cl)nnc1Cl.
What is the InChIKey of 3,6-dichloro-N-(2,4-dichlorophenyl)pyridazine-4-carboxamide?
The InChIKey is PARRBRLXALXTJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H5Cl4N3O/c12-5-1-2-8(7(13)3-5)16-11(19)6-4-9(14)17-18-10(6)15/h1-4H,(H,16,19).
What are the key properties of 3,6-dichloro-N-(2,4-dichlorophenyl)pyridazine-4-carboxamide?
3,6-dichloro-N-(2,4-dichlorophenyl)pyridazine-4-carboxamide has a molecular weight of 336.99 g/mol, XLogP of 4.34, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dichloro-N-(2,4-dichlorophenyl)pyridazine-4-carboxamide is sourced from PubChem (CID 13456235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).