2-[3-(2-chlorophenyl)-6-oxopyridazin-1-yl]-N-(2-phenylphenyl)acetamide

C24H18ClN3O2 — CID 3224562

IUPAC2-[3-(2-chlorophenyl)-6-oxopyridazin-1-yl]-N-(2-phenylphenyl)acetamide
SMILESO=C(Cn1nc(-c2ccccc2Cl)ccc1=O)Nc1ccccc1-c1ccccc1
InChIInChI=1S/C24H18ClN3O2/c25-20-12-6-4-11-19(20)22-14-15-24(30)28(27-22)16-23(29)26-21-13-7-5-10-18(21)17-8-2-1-3-9-17/h1-15H,16H2,(H,26,29)
InChIKeyCWCJGBUCLVXTOD-UHFFFAOYSA-N
MW415.88 g/mol
LogP4.87
Rot. Bonds5

About 2-[3-(2-chlorophenyl)-6-oxopyridazin-1-yl]-N-(2-phenylphenyl)acetamide

2-[3-(2-chlorophenyl)-6-oxopyridazin-1-yl]-N-(2-phenylphenyl)acetamide (PubChem CID 3224562) has the molecular formula C24H18ClN3O2 and a molecular weight of 415.88 g/mol. Its IUPAC name is 2-[3-(2-chlorophenyl)-6-oxopyridazin-1-yl]-N-(2-phenylphenyl)acetamide.

Molecular Properties

Compound Name2-[3-(2-chlorophenyl)-6-oxopyridazin-1-yl]-N-(2-phenylphenyl)acetamide
PubChem CID3224562
Molecular FormulaC24H18ClN3O2
Molecular Weight415.88 g/mol
Exact Mass415.11
IUPAC Name2-[3-(2-chlorophenyl)-6-oxopyridazin-1-yl]-N-(2-phenylphenyl)acetamide
SMILESO=C(Cn1nc(-c2ccccc2Cl)ccc1=O)Nc1ccccc1-c1ccccc1
InChIInChI=1S/C24H18ClN3O2/c25-20-12-6-4-11-19(20)22-14-15-24(30)28(27-22)16-23(29)26-21-13-7-5-10-18(21)17-8-2-1-3-9-17/h1-15H,16H2,(H,26,29)
InChIKeyCWCJGBUCLVXTOD-UHFFFAOYSA-N
XLogP4.87
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.88
LogP ≤ 54.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[3-(2-chlorophenyl)-6-oxopyridazin-1-yl]-N-(2-phenylphenyl)acetamide?
The IUPAC name of 2-[3-(2-chlorophenyl)-6-oxopyridazin-1-yl]-N-(2-phenylphenyl)acetamide (CID 3224562) is 2-[3-(2-chlorophenyl)-6-oxopyridazin-1-yl]-N-(2-phenylphenyl)acetamide.
What is the SMILES notation for 2-[3-(2-chlorophenyl)-6-oxopyridazin-1-yl]-N-(2-phenylphenyl)acetamide?
The canonical SMILES for 2-[3-(2-chlorophenyl)-6-oxopyridazin-1-yl]-N-(2-phenylphenyl)acetamide is O=C(Cn1nc(-c2ccccc2Cl)ccc1=O)Nc1ccccc1-c1ccccc1.
What is the InChIKey of 2-[3-(2-chlorophenyl)-6-oxopyridazin-1-yl]-N-(2-phenylphenyl)acetamide?
The InChIKey is CWCJGBUCLVXTOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18ClN3O2/c25-20-12-6-4-11-19(20)22-14-15-24(30)28(27-22)16-23(29)26-21-13-7-5-10-18(21)17-8-2-1-3-9-17/h1-15H,16H2,(H,26,29).
What are the key properties of 2-[3-(2-chlorophenyl)-6-oxopyridazin-1-yl]-N-(2-phenylphenyl)acetamide?
2-[3-(2-chlorophenyl)-6-oxopyridazin-1-yl]-N-(2-phenylphenyl)acetamide has a molecular weight of 415.88 g/mol, XLogP of 4.87, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2-chlorophenyl)-6-oxopyridazin-1-yl]-N-(2-phenylphenyl)acetamide is sourced from PubChem (CID 3224562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).