Basic information
- CAS
39928-75-1- Standard SMILES
Nc1ncnc2c(-c3ccccc3)c[nH]c12- InChIKey
YJGJVDAVZREQFP-UHFFFAOYSA-N- Molecular formula
- C12H10N4
- Average molar mass
- 210.23 g/mol
- Monoisotopic mass
- 210.09054634
Names & identifiers
- Preferred name
- 7-Phenyl-5h-pyrrolo[3,2-d]pyrimidin-4-amine
- IUPAC
- 7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-amine
Names & synonyms
39928-75-17-phenyl-5h-pyrrolo[3,2-d]pyrimidin-4-amineNSC162682DTXSID40303840NSC-162682
Database identifiers
- CAS
39928-75-1- PubChem CID
- 294396
- DTXSID
DTXSID40303840
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 67.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 239
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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