1,6-Dihydro-6,6-dimethyl-1-(3,4,5-trimethoxyphenyl)-1,3,5-triazine-2,4-diamine
Basic information
- CAS
136243-03-3- Standard SMILES
COc1cc(N2C(N)=NC(N)=NC2(C)C)cc(OC)c1OC- InChIKey
CEPCOAFRGSPTSE-UHFFFAOYSA-N- Molecular formula
- C14H21N5O3
- Average molar mass
- 307.35 g/mol
- Monoisotopic mass
- 307.16443955
Names & identifiers
- Preferred name
- 1,6-Dihydro-6,6-dimethyl-1-(3,4,5-trimethoxyphenyl)-1,3,5-triazine-2,4-diamine
- IUPAC
- 6,6-dimethyl-1-(3,4,5-trimethoxyphenyl)-1,3,5-triazine-2,4-diamine
Names & synonyms
1,3,5-Triazine-2,4-diamine, 1,6-dihydro-6,6-dimethyl-1-(3,4,5-trimethoxyphenyl)-ERV058H23ZUNII-ERV058H23ZDTXSID801597471,6-Dihydro-6,6-dimethyl-1-(3,4,5-trimethoxyphenyl)-1,3,5-triazine-2,4-diamineRefChem:196855DTXCID0082238136243-03-3NSC 158695NSC1586956,6-dimethyl-1-(3,4,5-trimethoxyphenyl)-1,3,5-triazine-2,4-diamine6,6-dimethyl-1-(3,4,5-trimethoxyphenyl)-1,6-dihydro-1,3,5-triazine-2,4-diamine
Database identifiers
- CAS
136243-03-3- PubChem CID
- 169976
- DTXSID
DTXSID80159747- UNII
- ERV058H23Z
- Nikkaji
- J419.883B
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 451
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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