Basic information
- CAS
36896-72-7- Standard SMILES
Cc1c(-c2ccccc2)[nH]c2c1c(=O)n(C)c(=O)n2C- InChIKey
FVZIDICVHNUBNH-UHFFFAOYSA-N- Molecular formula
- C15H15N3O2
- Average molar mass
- 269.3 g/mol
- Monoisotopic mass
- 269.11642673
Names & identifiers
- Preferred name
- 1H-Pyrrolo(2,3-d)pyrimidine-2,4(3H,7H)-dione, 6-phenyl-1,3,5-trimethyl-
- IUPAC
- 1,3,5-trimethyl-6-phenyl-7H-pyrrolo[2,3-d]pyrimidine-2,4-dione
- English name
- 2,4,7-trimethyl-8-phenyl-2,4,9-triazabicyclo[4.3.0]nona-7,10-diene-3,5 -dione
- Molecular formula
- C15H15N3O2
- Molecular weight
- 269.2985
Names & synonyms
BRN 062073036896-72-71H-Pyrrolo(2,3-d)pyrimidine-2,4(3H,7H)-dione, 6-phenyl-1,3,5-trimethyl-DTXSID601903756-Phenyl-1,3,5-trimethyl-1H-pyrrolo(2,3-d)pyrimidine-2,4(3H,7H)-dioneRefChem:240821DTXCID701128661,3,5-trimethyl-6-phenyl-1h-pyrrolo[2,3-d]pyrimidine-2,4(3h,7h)-dione2,4,7-trimethyl-8-phenyl-2,4,9-triazabicyclo[4.3.0]nona-7,10-diene-3,5 -dione
Database identifiers
- CAS
36896-72-7- PubChem CID
- 215965
- DTXSID
DTXSID60190375
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 56.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 419
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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