Basic information
- CAS
34594-44-0- Standard SMILES
CCOc1ccc(-n2c(C)nc3nccnc3c2=O)cc1- InChIKey
NVPHRKOYLQIZSC-UHFFFAOYSA-N- Molecular formula
- C15H14N4O2
- Average molar mass
- 282.3 g/mol
- Monoisotopic mass
- 282.1116757
Names & identifiers
- Preferred name
- 4(3H)-Pteridinone, 3-(p-ethoxyphenyl)-2-methyl-
- IUPAC
- 3-(4-ethoxyphenyl)-2-methylpteridin-4-one
- English name
- 3-(p-Ethoxyphenyl)-2-methyl-4(3H)-pteridinone
- Molecular weight
- 0
Names & synonyms
BRN 11425273-(p-Ethoxyphenyl)-2-methyl-4(3H)-pteridinone4(3H)-Pteridinone, 3-(p-ethoxyphenyl)-2-methyl-34594-44-0DTXSID501881605-26-13-00326 (Beilstein Handbook Reference)RefChem:283712DTXCID801106513-(4-ethoxyphenyl)-2-methylpteridin-4(3h)-one
Database identifiers
- CAS
34594-44-0- PubChem CID
- 214923
- DTXSID
DTXSID50188160- Nikkaji
- J113.489B
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 67.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 418
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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