Basic information
- CAS
7770-54-9- Standard SMILES
Cc1[nH]c2ccccc2c1C(c1ccc(N)cc1)c1c(C)[nH]c2ccccc12- InChIKey
UGXXHPQLFLIBIP-UHFFFAOYSA-N- Molecular formula
- C25H23N3
- Average molar mass
- 365.5 g/mol
- Monoisotopic mass
- 365.18919775
Names & identifiers
- Preferred name
- 4-[bis(2-methyl-1H-indol-3-yl)methyl]aniline
- IUPAC
- 4-[bis(2-methyl-1H-indol-3-yl)methyl]aniline
Names & synonyms
7770-54-94-[bis(2-methyl-1H-indol-3-yl)methyl]anilineNSC403185DTXSID50323150NSC-403185
Database identifiers
- CAS
7770-54-9- PubChem CID
- 345520
- DTXSID
DTXSID50323150
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 57.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 492
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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