2,4,7-Triamino-6-o-tolylpteridine
Basic information
- CAS
2853-69-2- Standard SMILES
Cc1ccccc1-c1nc2c(N)nc(N)nc2nc1N- InChIKey
GXCOXYQKWSWCGG-UHFFFAOYSA-N- Molecular formula
- C13H13N7
- Average molar mass
- 267.29 g/mol
- Monoisotopic mass
- 267.12324344
Names & identifiers
- Preferred name
- 2,4,7-Triamino-6-o-tolylpteridine
- IUPAC
- 6-(2-methylphenyl)pteridine-2,4,7-triamine
Names & synonyms
Wrair-ZB2853-69-22,4,7-Triamino-6-o-tolylpteridine2,4,7-Pteridinetriamine, 6-(2-methylphenyl)-U7TEV282FUNSC-19441WR-3090RefChem:1059658Pteridine, 6-o-tolyl-2,4,7-triamino-FDA 0283NSC194416-(2-methylphenyl)pteridine-2,4,7-triamine
Show more names
WR 3090NSC 19441UNII-U7TEV282FUBRN 05540225-26-17-00451 (Beilstein Handbook Reference)CHEMBL1992508SCHEMBL10456495DTXSID40182753
Database identifiers
- CAS
2853-69-2- PubChem CID
- 95122
- DTXSID
DTXSID40182753- ChEMBL
CHEMBL1992508- UNII
- U7TEV282FU
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 130 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 339
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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