4-(2-hydroxyphenyl)-2-phenyl-6-pyridin-2-yl-4,5-dihydropyridazin-3-one

C21H17N3O2 — CID 10132195

IUPAC4-(2-hydroxyphenyl)-2-phenyl-6-pyridin-2-yl-4,5-dihydropyridazin-3-one
SMILESO=C1C(c2ccccc2O)CC(c2ccccn2)=NN1c1ccccc1
InChIInChI=1S/C21H17N3O2/c25-20-12-5-4-10-16(20)17-14-19(18-11-6-7-13-22-18)23-24(21(17)26)15-8-2-1-3-9-15/h1-13,17,25H,14H2
InChIKeyISAMKLYODVTVIT-UHFFFAOYSA-N
MW343.39 g/mol
LogP3.71
Rot. Bonds3

About 4-(2-hydroxyphenyl)-2-phenyl-6-pyridin-2-yl-4,5-dihydropyridazin-3-one

4-(2-hydroxyphenyl)-2-phenyl-6-pyridin-2-yl-4,5-dihydropyridazin-3-one (PubChem CID 10132195) has the molecular formula C21H17N3O2 and a molecular weight of 343.39 g/mol. Its IUPAC name is 4-(2-hydroxyphenyl)-2-phenyl-6-pyridin-2-yl-4,5-dihydropyridazin-3-one.

Molecular Properties

Compound Name4-(2-hydroxyphenyl)-2-phenyl-6-pyridin-2-yl-4,5-dihydropyridazin-3-one
PubChem CID10132195
Molecular FormulaC21H17N3O2
Molecular Weight343.39 g/mol
Exact Mass343.13
IUPAC Name4-(2-hydroxyphenyl)-2-phenyl-6-pyridin-2-yl-4,5-dihydropyridazin-3-one
SMILESO=C1C(c2ccccc2O)CC(c2ccccn2)=NN1c1ccccc1
InChIInChI=1S/C21H17N3O2/c25-20-12-5-4-10-16(20)17-14-19(18-11-6-7-13-22-18)23-24(21(17)26)15-8-2-1-3-9-15/h1-13,17,25H,14H2
InChIKeyISAMKLYODVTVIT-UHFFFAOYSA-N
XLogP3.71
TPSA65.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.39
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2-hydroxyphenyl)-2-phenyl-6-pyridin-2-yl-4,5-dihydropyridazin-3-one?
The IUPAC name of 4-(2-hydroxyphenyl)-2-phenyl-6-pyridin-2-yl-4,5-dihydropyridazin-3-one (CID 10132195) is 4-(2-hydroxyphenyl)-2-phenyl-6-pyridin-2-yl-4,5-dihydropyridazin-3-one.
What is the SMILES notation for 4-(2-hydroxyphenyl)-2-phenyl-6-pyridin-2-yl-4,5-dihydropyridazin-3-one?
The canonical SMILES for 4-(2-hydroxyphenyl)-2-phenyl-6-pyridin-2-yl-4,5-dihydropyridazin-3-one is O=C1C(c2ccccc2O)CC(c2ccccn2)=NN1c1ccccc1.
What is the InChIKey of 4-(2-hydroxyphenyl)-2-phenyl-6-pyridin-2-yl-4,5-dihydropyridazin-3-one?
The InChIKey is ISAMKLYODVTVIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17N3O2/c25-20-12-5-4-10-16(20)17-14-19(18-11-6-7-13-22-18)23-24(21(17)26)15-8-2-1-3-9-15/h1-13,17,25H,14H2.
What are the key properties of 4-(2-hydroxyphenyl)-2-phenyl-6-pyridin-2-yl-4,5-dihydropyridazin-3-one?
4-(2-hydroxyphenyl)-2-phenyl-6-pyridin-2-yl-4,5-dihydropyridazin-3-one has a molecular weight of 343.39 g/mol, XLogP of 3.71, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-hydroxyphenyl)-2-phenyl-6-pyridin-2-yl-4,5-dihydropyridazin-3-one is sourced from PubChem (CID 10132195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).