Basic information
- CAS
66147-61-3- Standard SMILES
CS(=O)(=O)O.NC(=O)CCCCCc1ccc(Nc2c3ccccc3nc3ccccc23)cc1- InChIKey
JCVJLSJAEWLINE-UHFFFAOYSA-N- Molecular formula
- C26H29N3O4S
- Average molar mass
- 479.6 g/mol
- Monoisotopic mass
- 479.18787759
Names & identifiers
- Preferred name
- Hexanamide, 6-(p-(9-acridinylamino)phenyl)-, methanesulfonate
- IUPAC
- 6-[4-(acridin-9-ylamino)phenyl]hexanamide;methanesulfonic acid
Names & synonyms
66147-61-3HEXANAMIDE, 6-(p-(9-ACRIDINYLAMINO)PHENYL)-, METHANESULFONATE6-(p-(9-Acridinylamino)phenyl)hexanamide, methanesulfonateDTXSID00216341RefChem:347587DTXCID00138832CHEMBL3249629Methanesulfonic acid--6-{4-[(acridin-9-yl)amino]phenyl}hexanamide (1/1)
Database identifiers
- CAS
66147-61-3- PubChem CID
- 47833
- DTXSID
DTXSID00216341- ChEMBL
CHEMBL3249629
Properties
Computed structural properties
- Topological polar surface area
- 131 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 587
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…