Basic information
- CAS
771422-85-6- Standard SMILES
O=S(=O)(CCCCCCNc1ccnc2ccccc12)Nc1ccc(Nc2c3ccccc3nc3ccccc23)cc1- InChIKey
RLMGEJGAGBUZKI-UHFFFAOYSA-N- Molecular formula
- C34H33N5O2S
- Average molar mass
- 575.7 g/mol
- Monoisotopic mass
- 575.23549649
Names & identifiers
- Preferred name
- N-[4-(9-Acridinylamino)phenyl]-6-(4-quinolinylamino)-1-hexanesulfonamide
- IUPAC
- N-[4-(acridin-9-ylamino)phenyl]-6-(quinolin-4-ylamino)hexane-1-sulfonamide
Names & synonyms
N-[4-(9-Acridinylamino)phenyl]-6-(4-quinolinylamino)-1-hexanesulfonamide771422-85-6CHEMBL3305501DTXSID301150681N-{4-[(Acridin-9-yl)amino]phenyl}-6-[(quinolin-4-yl)amino]hexane-1-sulfonamide
Database identifiers
- CAS
771422-85-6- PubChem CID
- 48018
- DTXSID
DTXSID301150681- ChEMBL
CHEMBL3305501
Properties
Computed structural properties
- XLogP
- 7.4
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 12
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 897
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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