Basic information
- CAS
6504-77-4- Standard SMILES
COCCNC(=O)c1nc2c(N)nc(-c3ccccc3)nc2nc1NCCOC- InChIKey
XJDALFQCSYEWSB-UHFFFAOYSA-N- Molecular formula
- C19H23N7O3
- Average molar mass
- 397.4 g/mol
- Monoisotopic mass
- 397.18623762
Names & identifiers
- Preferred name
- 6-Pteridinecarboxamide, 4-amino-N-(2-methoxyethyl)-7-((2-methoxyethyl)amino)-2-phenyl-
- IUPAC
- 4-amino-N-(2-methoxyethyl)-7-(2-methoxyethylamino)-2-phenylpteridine-6-carboxamide
- English name
- 4-Amino-N-(2-methoxyethyl)-7-[(2-methoxyethyl)amino]-2-phenyl-6-pteridinecarboxamide
- Molecular formula
- C19H23N7O3
- Molecular weight
- 397.43
Names & synonyms
WY 5256BRN 08617246-Pteridinecarboxamide, 4-amino-N-(2-methoxyethyl)-7-((2-methoxyethyl)amino)-2-phenyl-DTXSID302153624-Amino-7-(2-methoxyethylamino)-N-(2-methoxyethyl)-2-phenyl-6-pteridine-carboxamide6-Pteridinecarboxamide, 4-amino-N-(2-methoxyethyl)-7-[(2-methoxyethyl)amino]-2-phenyl-RefChem:309373DTXCID301378536504-77-45D6DT49DP94-amino-N-(2-methoxyethyl)-7-[(2-methoxyethyl)amino]-2-phenylpteridine-6-carboxamide4-Amino-7-(2-methoxyethylamino)-N-(2-methoxyethyl)-2-phenyl-6-pteridinecarboxamide
Show more names
Wy-52564-Amino-N-(2-methoxyethyl)-7-[(2-methoxyethyl)amino]-2-phenyl-6-pteridinecarboxamide
4-Amino-N-(2-methoxyethyl)-7-(2-methoxyethylamino)-2-phenyl-6-pteridinecarboxamide
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 137 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 9
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 506
Physicochemical properties
- Boiling point
- 520.88 °C · 520.88°C (rough estimate)
- Density
- 1.3079 · 1.3079 (rough estimate)
- refractive index
- 1.68 · 1.6800 (estimate)
- FDA UNII
- 5 D6DT49DP9 · 5D6DT49DP9
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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