Basic information
- Standard SMILES
CC1(C)N=C(N)N=C(N)N1OCc1ccccc1.Cl- InChIKey
KWMOLLVQGMXNTM-UHFFFAOYSA-N- Molecular formula
- C12H18ClN5O
- Average molar mass
- 283.76 g/mol
Names & identifiers
- Preferred name
- 4,6-Diamino-1,2-dihydro-1-phenylmethoxy-2,2-dimethyl-1,3,5-triazine hydrochloride
- IUPAC
- 6,6-dimethyl-1-phenylmethoxy-1,3,5-triazine-2,4-diamine;hydrochloride
Names & synonyms
CHEMBL1824770SCHEMBL8934038KWMOLLVQGMXNTM-UHFFFAOYSA-N4,6-diamino-1,2-dihydro-1-phenylmethoxy-2,2-dimethyl-1,3,5-triazine hydrochloride
Database identifiers
- PubChem CID
- 19089923
- ChEMBL
CHEMBL1824770
Properties
Computed structural properties
- Topological polar surface area
- 89.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 357
Related reactions
1 records
Compound notes
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