5-(Dimethylamino)-1,3-dimethyl-1,10a-dihydro-2H-pyrido[1,2-a]pyrimido[4,5-d]pyrimidine-2,4(3H)-dione
Basic information
- CAS
78422-90-9- Standard SMILES
CN(C)C1=c2c(=O)n(C)c(=O)n(C)c2=NC2C=CC=CN12- InChIKey
WNTMIDUCIYOJNT-UHFFFAOYSA-N- Molecular formula
- C14H17N5O2
- Average molar mass
- 287.32 g/mol
- Monoisotopic mass
- 287.1382248
Names & identifiers
- Preferred name
- 5-(Dimethylamino)-1,3-dimethyl-1,10a-dihydro-2H-pyrido[1,2-a]pyrimido[4,5-d]pyrimidine-2,4(3H)-dione
- IUPAC
- 2-(dimethylamino)-5,7-dimethyl-1,5,7,9-tetrazatricyclo[8.4.0.03,8]tetradeca-2,8,11,13-tetraene-4,6-dione
Names & synonyms
78422-90-9NSC3551413YLN7K7VKM5-(Dimethylamino)-1,3-dimethyl-1H-pyrido[1,2-a]pyrimido[4,5-d]pyrimidine-2,4(3H,10aH)-dioneNSC-3551415-(Dimethylamino)-1,3-dimethyl-1,10a-dihydro-2H-pyrido[1,2-a]pyrimido[4,5-d]pyrimidine-2,4(3H)-dione5-(Dimethylamino)-1,10a-dihydro-1,3-dimethyl-2H-pyrido(1,2-a)pyrimido(4,5-d)pyrimidine-2,4(3H)-dione5-(Dimethylamino)-1,3-dimethyl-1,10a-dihydro-2H-pyrido(1,2-a)pyrimido(4,5-d)pyrimidine-2,4(3H)-dioneNSC 355141UNII-3YLN7K7VKM5-(dimethylamino)-1,3-dimethyl-10aH-pyrido[[?]]pyrimido[[?]]pyrimidine-2,4-dione2H-PYRIDO(1,2-A)PYRIMIDO(4,5-D)PYRIMIDINE-2,4(3H)-DIONE, 5-(DIMETHYLAMINO)-1,10A-DIHYDRO-1,3-DIMETHYL-
Database identifiers
- CAS
78422-90-9- PubChem CID
- 337370
- UNII
- 3YLN7K7VKM
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 59.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 644
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Compound notes
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