pyrimidin-4(1H)-one, 2,3-dihydro-6-hydroxy-5-phenyl-2-selenoxo-

C10H7N2O2Se — CID 171384669

IUPAC—
SMILESO=c1[nH]c([Se])nc(O)c1-c1ccccc1
InChIInChI=1S/C10H7N2O2Se/c13-8-7(6-4-2-1-3-5-6)9(14)12-10(15)11-8/h1-5H,(H2,11,12,13,14)
InChIKeyOTLLVAFTOFKPLT-UHFFFAOYSA-N
MW266.14 g/mol
LogP-0.06
Rot. Bonds1

About pyrimidin-4(1H)-one, 2,3-dihydro-6-hydroxy-5-phenyl-2-selenoxo-

pyrimidin-4(1H)-one, 2,3-dihydro-6-hydroxy-5-phenyl-2-selenoxo- (PubChem CID 171384669) has the molecular formula C10H7N2O2Se and a molecular weight of 266.14 g/mol.

Molecular Properties

Compound Namepyrimidin-4(1H)-one, 2,3-dihydro-6-hydroxy-5-phenyl-2-selenoxo-
PubChem CID171384669
Molecular FormulaC10H7N2O2Se
Molecular Weight266.14 g/mol
Exact Mass266.97
IUPAC Name—
SMILESO=c1[nH]c([Se])nc(O)c1-c1ccccc1
InChIInChI=1S/C10H7N2O2Se/c13-8-7(6-4-2-1-3-5-6)9(14)12-10(15)11-8/h1-5H,(H2,11,12,13,14)
InChIKeyOTLLVAFTOFKPLT-UHFFFAOYSA-N
XLogP-0.06
TPSA65.98 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.14
LogP ≤ 5-0.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of pyrimidin-4(1H)-one, 2,3-dihydro-6-hydroxy-5-phenyl-2-selenoxo-?
The IUPAC name of pyrimidin-4(1H)-one, 2,3-dihydro-6-hydroxy-5-phenyl-2-selenoxo- (CID 171384669) is not available.
What is the SMILES notation for pyrimidin-4(1H)-one, 2,3-dihydro-6-hydroxy-5-phenyl-2-selenoxo-?
The canonical SMILES for pyrimidin-4(1H)-one, 2,3-dihydro-6-hydroxy-5-phenyl-2-selenoxo- is O=c1[nH]c([Se])nc(O)c1-c1ccccc1.
What is the InChIKey of pyrimidin-4(1H)-one, 2,3-dihydro-6-hydroxy-5-phenyl-2-selenoxo-?
The InChIKey is OTLLVAFTOFKPLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7N2O2Se/c13-8-7(6-4-2-1-3-5-6)9(14)12-10(15)11-8/h1-5H,(H2,11,12,13,14).
What are the key properties of pyrimidin-4(1H)-one, 2,3-dihydro-6-hydroxy-5-phenyl-2-selenoxo-?
pyrimidin-4(1H)-one, 2,3-dihydro-6-hydroxy-5-phenyl-2-selenoxo- has a molecular weight of 266.14 g/mol, XLogP of -0.06, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for pyrimidin-4(1H)-one, 2,3-dihydro-6-hydroxy-5-phenyl-2-selenoxo- is sourced from PubChem (CID 171384669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).