Basic information
- CAS
5440-98-2- Standard SMILES
c1ccc(CN=C(NCc2ccccc2)NCc2ccccc2)cc1- InChIKey
CRQXNVPOHIITIU-UHFFFAOYSA-N- Molecular formula
- C22H23N3
- Average molar mass
- 329.4 g/mol
- Monoisotopic mass
- 329.18919775
Names & identifiers
- Preferred name
- 1,2,3-Tribenzylguanidine
- IUPAC
- 1,2,3-tribenzylguanidine
Names & synonyms
1,2,3-tribenzylguanidineMLS0026387365440-98-2N,N',N''-tribenzylguanidineNSC20644SCHEMBL1792490CHEMBL1702199SCHEMBL16443508DTXSID30275022HMS3078C17NSC-20644SMR001548203
Show more names
DS-008175
Database identifiers
- CAS
5440-98-2- PubChem CID
- 33144
- DTXSID
DTXSID30275022- ChEMBL
CHEMBL1702199- Nikkaji
- J238.951G
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 36.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 8
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 351
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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