1,3,7,9-Tetramethylpyrido[2,3-D:6,5-D']dipyrimidine-2,4,6,8(1H,3H,7H,9H)tetrone
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Basic information
- CAS
796-39-4- Standard SMILES
Cn1c(=O)c2cc3c(=O)n(C)c(=O)n(C)c3nc2n(C)c1=O- InChIKey
WBKPVHNGZBBJTE-UHFFFAOYSA-N- Molecular formula
- C13H13N5O4
- Average molar mass
- 303.27 g/mol
- Monoisotopic mass
- 303.09675391
Names & identifiers
- Preferred name
- 1,3,7,9-Tetramethylpyrido[2,3-D:6,5-D']dipyrimidine-2,4,6,8(1H,3H,7H,9H)tetrone
- IUPAC
- 4,6,12,14-tetramethyl-2,4,6,12,14-pentazatricyclo[8.4.0.03,8]tetradeca-1,3(8),9-triene-5,7,11,13-tetrone
Names & synonyms
NSC252013796-39-41,3,7,9-tetramethylpyrido[2,3-d:6,5-d']dipyrimidine-2,4,6,8(1H,3H,7H,9H)-tetraone1,3,7,9-TETRAMETHYLPYRIDO[2,3-D:6,5-D']DIPYRIMIDINE-2,4,6,8(1H,3H,7H,9H)TETRONE1,3,7,9-Tetramethylpyrido[2,3-d:6,5-d']dipyrimidine-2,4,6,8(1H,3H,7H,9H)-tetroneDTXSID90312285STL521220AKOS030504772NSC-2520131,1,3,3-tetramethyl[?]-2,2,6,6-tetroneEN300-75495121,3,7,9-tetramethylpyrido-[2,3-d:6,5-d']-dipyrimidine-2,4,6,8-tetrone
Show more names
1,7,9-TETRAMETHYLPYRIDO[2,3-D:6,5-D']DIPYRIMIDINE-2,4,6,8(1H,3H,7H,9H)TETRONE1,3,7,9-Tetramethyl-1,3,7,9-tetrahydropyrimidino[5',4'-6,5]pyridino[2,3-d]pyrimidine-2,4,6,8-tetraone4,6,12,14-tetramethyl-2,4,6,12,14-pentaazatricyclo[8.4.0.0,3,8]tetradeca-1,3(8),9-triene-5,7,11,13-tetrone4,6,12,14-tetramethyl-2,4,6,12,14-pentazatricyclo[8.4.0.03,8]tetradeca-1,3(8),9-triene-5,7,11,13-tetrone
Database identifiers
- CAS
796-39-4- PubChem CID
- 317993
- DTXSID
DTXSID90312285- Nikkaji
- J501.927C
Properties
Computed structural propertiesFilling in
- XLogP
- -0.7
- Topological polar surface area
- 94.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 531
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Compound notes
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