Basic information
- CAS
3748-01-4- Standard SMILES
CC(=O)N1Cc2c(N)ncnc2C1C- InChIKey
NAXMEWWOVWHRTI-UHFFFAOYSA-N- Molecular formula
- C9H12N4O
- Average molar mass
- 192.22 g/mol
- Monoisotopic mass
- 192.10111102
Names & identifiers
- Preferred name
- 1-(4-Amino-7-methyl-5,7-dihydro-6h-pyrrolo[3,4-d]pyrimidin-6-yl)ethanone
- IUPAC
- 1-(4-amino-7-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-6-yl)ethanone
Names & synonyms
3748-01-41-(4-amino-7-methyl-5,7-dihydro-6h-pyrrolo[3,4-d]pyrimidin-6-yl)ethanoneNSC107250DTXSID40296041NSC-1072501-(4-Amino-7-methyl-5,7-dihydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl)ethan-1-one
Database identifiers
- CAS
3748-01-4- PubChem CID
- 267682
- DTXSID
DTXSID40296041
Properties
Computed structural properties
- XLogP
- -0.8
- Topological polar surface area
- 72.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 245
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…