5-(3-hydroxyphenyl)-3-methyl-7H-imidazo[4,5-f][1,3]benzoxazole-2,6-dione

C15H11N3O4 — CID 168926559

IUPAC5-(3-hydroxyphenyl)-3-methyl-7H-imidazo[4,5-f][1,3]benzoxazole-2,6-dione
SMILESCn1c(=O)oc2cc3[nH]c(=O)n(-c4cccc(O)c4)c3cc21
InChIInChI=1S/C15H11N3O4/c1-17-12-7-11-10(6-13(12)22-15(17)21)16-14(20)18(11)8-3-2-4-9(19)5-8/h2-7,19H,1H3,(H,16,20)
InChIKeyFUEOIUWMJNNZHT-UHFFFAOYSA-N
MW297.27 g/mol
LogP1.47
Rot. Bonds1

About 5-(3-hydroxyphenyl)-3-methyl-7H-imidazo[4,5-f][1,3]benzoxazole-2,6-dione

5-(3-hydroxyphenyl)-3-methyl-7H-imidazo[4,5-f][1,3]benzoxazole-2,6-dione (PubChem CID 168926559) has the molecular formula C15H11N3O4 and a molecular weight of 297.27 g/mol. Its IUPAC name is 5-(3-hydroxyphenyl)-3-methyl-7H-imidazo[4,5-f][1,3]benzoxazole-2,6-dione.

Molecular Properties

Compound Name5-(3-hydroxyphenyl)-3-methyl-7H-imidazo[4,5-f][1,3]benzoxazole-2,6-dione
PubChem CID168926559
Molecular FormulaC15H11N3O4
Molecular Weight297.27 g/mol
Exact Mass297.07
IUPAC Name5-(3-hydroxyphenyl)-3-methyl-7H-imidazo[4,5-f][1,3]benzoxazole-2,6-dione
SMILESCn1c(=O)oc2cc3[nH]c(=O)n(-c4cccc(O)c4)c3cc21
InChIInChI=1S/C15H11N3O4/c1-17-12-7-11-10(6-13(12)22-15(17)21)16-14(20)18(11)8-3-2-4-9(19)5-8/h2-7,19H,1H3,(H,16,20)
InChIKeyFUEOIUWMJNNZHT-UHFFFAOYSA-N
XLogP1.47
TPSA93.16 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.27
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(3-hydroxyphenyl)-3-methyl-7H-imidazo[4,5-f][1,3]benzoxazole-2,6-dione?
The IUPAC name of 5-(3-hydroxyphenyl)-3-methyl-7H-imidazo[4,5-f][1,3]benzoxazole-2,6-dione (CID 168926559) is 5-(3-hydroxyphenyl)-3-methyl-7H-imidazo[4,5-f][1,3]benzoxazole-2,6-dione.
What is the SMILES notation for 5-(3-hydroxyphenyl)-3-methyl-7H-imidazo[4,5-f][1,3]benzoxazole-2,6-dione?
The canonical SMILES for 5-(3-hydroxyphenyl)-3-methyl-7H-imidazo[4,5-f][1,3]benzoxazole-2,6-dione is Cn1c(=O)oc2cc3[nH]c(=O)n(-c4cccc(O)c4)c3cc21.
What is the InChIKey of 5-(3-hydroxyphenyl)-3-methyl-7H-imidazo[4,5-f][1,3]benzoxazole-2,6-dione?
The InChIKey is FUEOIUWMJNNZHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N3O4/c1-17-12-7-11-10(6-13(12)22-15(17)21)16-14(20)18(11)8-3-2-4-9(19)5-8/h2-7,19H,1H3,(H,16,20).
What are the key properties of 5-(3-hydroxyphenyl)-3-methyl-7H-imidazo[4,5-f][1,3]benzoxazole-2,6-dione?
5-(3-hydroxyphenyl)-3-methyl-7H-imidazo[4,5-f][1,3]benzoxazole-2,6-dione has a molecular weight of 297.27 g/mol, XLogP of 1.47, 1 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-hydroxyphenyl)-3-methyl-7H-imidazo[4,5-f][1,3]benzoxazole-2,6-dione is sourced from PubChem (CID 168926559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).