2,4(1H,3H)-Pteridinedione, 6,7-bis(4-methoxyphenyl)-1,3-dimethyl-
Basic information
- CAS
51445-47-7- Standard SMILES
COc1ccc(-c2nc3c(=O)n(C)c(=O)n(C)c3nc2-c2ccc(OC)cc2)cc1- InChIKey
KRHBJPIICLTYIE-UHFFFAOYSA-N- Molecular formula
- C22H20N4O4
- Average molar mass
- 404.4 g/mol
- Monoisotopic mass
- 404.14845513
Names & identifiers
- Preferred name
- 2,4(1H,3H)-Pteridinedione, 6,7-bis(4-methoxyphenyl)-1,3-dimethyl-
- IUPAC
- 6,7-bis(4-methoxyphenyl)-1,3-dimethylpteridine-2,4-dione
Names & synonyms
51445-47-72,4(1H,3H)-Pteridinedione, 6,7-bis(4-methoxyphenyl)-1,3-dimethyl-MMB7PE1Q3NUNII-MMB7PE1Q3NNSC280486NSC 280486NSC-2804866,7-Bis(4-methoxyphenyl)-1,3-dimethyl-2,4(1H,3H)-pteridinedione6,7-bis(4-methoxyphenyl)-1,3-dimethyl-pteridine-2,4-dioneDTXSID601994246,7-bis(4-methoxyphenyl)-1,3-dimethylpteridine-2,4(1H,3H)-dioneDS-015657
Database identifiers
- CAS
51445-47-7- PubChem CID
- 322528
- DTXSID
DTXSID60199424- UNII
- MMB7PE1Q3N
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 84.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 631
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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