Benzamidine, N-(p-(2-(methylphenylamino)ethoxy)phenyl)-N'-phenyl-
Basic information
- CAS
80790-46-1- Standard SMILES
CN(CCOc1ccc(N=C(Nc2ccccc2)c2ccccc2)cc1)c1ccccc1- InChIKey
UBTNLNDCRLQHBV-UHFFFAOYSA-N- Molecular formula
- C28H27N3O
- Average molar mass
- 421.5 g/mol
- Monoisotopic mass
- 421.21541249
Names & identifiers
- Preferred name
- Benzamidine, N-(p-(2-(methylphenylamino)ethoxy)phenyl)-N'-phenyl-
- IUPAC
- N'-[4-[2-(N-methylanilino)ethoxy]phenyl]-N-phenylbenzenecarboximidamide
- English name
- N-[p-[2-(Methylphenylamino)ethoxy]phenyl]-N'-phenylbenzamidine
- Molecular formula
- C28H27N3O
- Molecular weight
- 421.53
Names & synonyms
BRN 5141634BENZAMIDINE, N-(p-(2-(METHYLPHENYLAMINO)ETHOXY)PHENYL)-N'-PHENYL-80790-46-1DTXSID20230640N-(p-(2-(Methylphenylamino)ethoxy)phenyl)-N'-phenyl-benzamidineRefChem:322672DTXCID50153131CHEMBL421275N'-(4-{2-[methyl(phenyl)amino]ethoxy}phenyl)-N-phenylbenzenecarboximidamideN-[p-[2-(Methylphenylamino)ethoxy]phenyl]-N'-phenylbenzamidineBenzenecarboximidamide, N-[4-[2-(methylphenylamino)ethoxy]phenyl]-N'-phenyl-
Database identifiers
- CAS
80790-46-1- PubChem CID
- 54666
- DTXSID
DTXSID20230640- ChEMBL
CHEMBL421275- Nikkaji
- J149.192J
Properties
Computed structural properties
- XLogP
- 6.4
- Topological polar surface area
- 36.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 539
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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