Basic information
- CAS
55687-57-5- Standard SMILES
COc1cc(Cc2cnc(N)nc2N)cc(OC)c1C(N)=O- InChIKey
LPLBKXARLUPNDA-UHFFFAOYSA-N- Molecular formula
- C14H17N5O3
- Average molar mass
- 303.32 g/mol
- Monoisotopic mass
- 303.13313942
Names & identifiers
- Preferred name
- Benzamide, 4-((2,4-diamino-5-pyrimidinyl)methyl)-2,6-dimethoxy-
- IUPAC
- 4-[(2,4-diaminopyrimidin-5-yl)methyl]-2,6-dimethoxybenzamide
- English name
- 4-[(2,4-diaminopyrimidin-5-yl)methyl]-2,6-dimethoxy-benzamide
- Molecular formula
- C14H17N5O3
- Molecular weight
- 0
Names & synonyms
55687-57-5BRN 0897517Benzamide, 4-((2,4-diamino-5-pyrimidinyl)methyl)-2,6-dimethoxy-4-((2,4-Diamino-5-pyrimidinyl)methyl)-2,6-dimethoxybenzamideDTXSID302042115-25-17-00185 (Beilstein Handbook Reference)RefChem:321557DTXCID301267024-[(2,4-diaminopyrimidin-5-yl)methyl]-2,6-dimethoxybenzamide4-((2,4-Diaminopyrimidin-5-yl)methyl)-2,6-dimethoxybenzamideSCHEMBL11848485Famoxadone Impurity 6
Show more names
4-[(2,4-diaminopyrimidin-5-yl)methyl]-2,6-dimethoxy-benzamide
Database identifiers
- CAS
55687-57-5- PubChem CID
- 108752
- DTXSID
DTXSID30204211- Nikkaji
- J1.575.088J
Properties
Computed structural properties
- XLogP
- -0.9
- Topological polar surface area
- 139 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 369
Experimental & physicochemical properties
LogP-0.59
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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