2-[(2,4-dichlorophenyl)methyl]-6-(furan-2-yl)pyridazin-3-one

C15H10Cl2N2O2 — CID 7659505

IUPAC2-[(2,4-dichlorophenyl)methyl]-6-(furan-2-yl)pyridazin-3-one
SMILESO=c1ccc(-c2ccco2)nn1Cc1ccc(Cl)cc1Cl
InChIInChI=1S/C15H10Cl2N2O2/c16-11-4-3-10(12(17)8-11)9-19-15(20)6-5-13(18-19)14-2-1-7-21-14/h1-8H,9H2
InChIKeyZMULODHEUGSRPA-UHFFFAOYSA-N
MW321.16 g/mol
LogP3.86
Rot. Bonds3

About 2-[(2,4-dichlorophenyl)methyl]-6-(furan-2-yl)pyridazin-3-one

2-[(2,4-dichlorophenyl)methyl]-6-(furan-2-yl)pyridazin-3-one (PubChem CID 7659505) has the molecular formula C15H10Cl2N2O2 and a molecular weight of 321.16 g/mol. Its IUPAC name is 2-[(2,4-dichlorophenyl)methyl]-6-(furan-2-yl)pyridazin-3-one.

Molecular Properties

Compound Name2-[(2,4-dichlorophenyl)methyl]-6-(furan-2-yl)pyridazin-3-one
PubChem CID7659505
Molecular FormulaC15H10Cl2N2O2
Molecular Weight321.16 g/mol
Exact Mass320.01
IUPAC Name2-[(2,4-dichlorophenyl)methyl]-6-(furan-2-yl)pyridazin-3-one
SMILESO=c1ccc(-c2ccco2)nn1Cc1ccc(Cl)cc1Cl
InChIInChI=1S/C15H10Cl2N2O2/c16-11-4-3-10(12(17)8-11)9-19-15(20)6-5-13(18-19)14-2-1-7-21-14/h1-8H,9H2
InChIKeyZMULODHEUGSRPA-UHFFFAOYSA-N
XLogP3.86
TPSA48.03 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.16
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-aminopropyl)-6-(furan-2-yl)pyridazin-3-one
CID 52903518
6-(furan-2-yl)-2-[(4-nitrophenyl)methyl]pyridazin-3-one
CID 7659492
N-[2-(5-chloro-1H-indol-3-yl)ethyl]-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide
CID 53368196
1-[4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl]-2-[4-(difluoromethyl)-6-(furan-2-yl)-3-methylpyrazolo[5,4-b]pyridin-1-yl]ethanone
CID 19501481
2-[(3,3-difluorocyclobutyl)methyl]-6-(furan-2-yl)pyridazin-3-one
CID 167763079
N-[1-[(2,4-dichlorophenyl)methyl]-1,2,4-triazol-3-yl]-5-(furan-2-yl)-1H-pyrazole-3-carboxamide
CID 19514005
N-[4-fluoro-3-(trifluoromethyl)phenyl]-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide
CID 121049762
2-[(2-chlorophenyl)methyl]-6-(2,4,5-trimethylphenyl)pyridazin-3-one
CID 8699180
2,4-difluoro-N-[2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]ethyl]benzenesulfonamide
CID 16905618
6-(furan-2-yl)-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]pyridazin-3-one
CID 7658856
N-[2-(2,4-dichlorophenyl)ethyl]-3-(furan-2-yl)-1-(3-methylphenyl)pyrazole-5-carboxamide
CID 4309486
2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]-N-[2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]ethyl]propanamide
CID 121076228

Frequently Asked Questions

What is the IUPAC name of 2-[(2,4-dichlorophenyl)methyl]-6-(furan-2-yl)pyridazin-3-one?
The IUPAC name of 2-[(2,4-dichlorophenyl)methyl]-6-(furan-2-yl)pyridazin-3-one (CID 7659505) is 2-[(2,4-dichlorophenyl)methyl]-6-(furan-2-yl)pyridazin-3-one.
What is the SMILES notation for 2-[(2,4-dichlorophenyl)methyl]-6-(furan-2-yl)pyridazin-3-one?
The canonical SMILES for 2-[(2,4-dichlorophenyl)methyl]-6-(furan-2-yl)pyridazin-3-one is O=c1ccc(-c2ccco2)nn1Cc1ccc(Cl)cc1Cl.
What is the InChIKey of 2-[(2,4-dichlorophenyl)methyl]-6-(furan-2-yl)pyridazin-3-one?
The InChIKey is ZMULODHEUGSRPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10Cl2N2O2/c16-11-4-3-10(12(17)8-11)9-19-15(20)6-5-13(18-19)14-2-1-7-21-14/h1-8H,9H2.
What are the key properties of 2-[(2,4-dichlorophenyl)methyl]-6-(furan-2-yl)pyridazin-3-one?
2-[(2,4-dichlorophenyl)methyl]-6-(furan-2-yl)pyridazin-3-one has a molecular weight of 321.16 g/mol, XLogP of 3.86, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,4-dichlorophenyl)methyl]-6-(furan-2-yl)pyridazin-3-one is sourced from PubChem (CID 7659505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).