6-(2-(4-Hydroxyphenyl)diazenyl)-2,4(1H,3H)-pyrimidinedione
Basic information
- CAS
29050-86-0- Standard SMILES
O=c1cc(N=Nc2ccc(O)cc2)[nH]c(=O)[nH]1- InChIKey
WFCXSZSLXQJFDD-UHFFFAOYSA-N- Molecular formula
- C10H8N4O3
- Average molar mass
- 232.2 g/mol
- Monoisotopic mass
- 232.05964013
Overview
Inhibitor of DNA replication in gram-positive bacteria.
Names & identifiers
- Preferred name
- 6-(2-(4-Hydroxyphenyl)diazenyl)-2,4(1H,3H)-pyrimidinedione
- IUPAC
- 6-[(4-hydroxyphenyl)diazenyl]-1H-pyrimidine-2,4-dione
- English name
- Hydroxyphenylazouracil
- Molecular formula
- C10H8N4O3
- Molecular weight
- 232.2
Names & synonyms
HYDROXYPHENYLAZOURACIL29050-86-06-(4-Hydroxyphenylazo)uracilNSC-194250WE3ADR6JZFUracil, 6-((p-hydroxyphenyl)azo)-Uracil, 6-[(p-hydroxyphenyl)azo]-NSC-677287DTXSID8011943996-[2-(4-Hydroxyphenyl)diazenyl]-2,4(1H,3H)-pyrimidinedione6-(2-(4-Hydroxyphenyl)diazenyl)-2,4(1H,3H)-pyrimidinedioneRefChem:306485
Show more names
DTXCID301625640NSC1942502,4(1H,3H)-Pyrimidinedione, 6-[2-(4-hydroxyphenyl)diazenyl]-NSC6772876-((4-Hydroxyphenyl)diazenyl)-2,4-pyrimidinediol6-((p-Hydroxyphenyl)azo)uracilNSC 194250BRN 0919894
Database identifiers
- CAS
29050-86-0- PubChem CID
- 34444
- DTXSID
DTXSID801194399- ChEMBL
CHEMBL1742076、CHEMBL1985422- UNII
- WE3ADR6JZF
- Nikkaji
- J58.059G
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 383
Physicochemical properties
- Boiling point
- 374.35 °C · 374.35°C (rough estimate)
- Density
- 1.3715 · 1.3715 (rough estimate)
- refractive index
- 1.63 · 1.6300 (estimate)
- pka
- 5.44 · 5.44±0.10(Predicted)
- FDA UNII
- 3 ADR6JZF · WE3ADR6JZF
Chemistry & industry
Pharmacology
MeSH Pharmacological ClassificationCompounds that inhibit cell production of DNA or RNA.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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