1H-Indole-6-carboximidamide, 2-(3,4,5-trimethoxyphenyl)-
Basic information
- CAS
87550-53-6- Standard SMILES
COc1cc(-c2cc3ccc(C(=N)N)cc3[nH]2)cc(OC)c1OC- InChIKey
MZVRLTHTEMFHTA-UHFFFAOYSA-N- Molecular formula
- C18H19N3O3
- Average molar mass
- 325.4 g/mol
- Monoisotopic mass
- 325.14264148
Names & identifiers
- Preferred name
- 1H-Indole-6-carboximidamide, 2-(3,4,5-trimethoxyphenyl)-
- IUPAC
- 2-(3,4,5-trimethoxyphenyl)-1H-indole-6-carboximidamide
Names & synonyms
2-(3,4,5-Trimethoxyphenyl)-1H-indole-6-carboximidamide1H-INDOLE-6-CARBOXIMIDAMIDE, 2-(3,4,5-TRIMETHOXYPHENYL)-87550-53-6DTXSID30236456
Database identifiers
- CAS
87550-53-6- PubChem CID
- 55731
- DTXSID
DTXSID30236456
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 93.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 433
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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