Basic information
- CAS
72738-96-6- Standard SMILES
CS(=O)(=O)Nc1ccc(Nc2c3ccccc3nc3ccccc23)c(Cl)c1- InChIKey
UUUKGRTUPQLJOQ-UHFFFAOYSA-N- Molecular formula
- C20H16ClN3O2S
- Average molar mass
- 397.9 g/mol
- Monoisotopic mass
- 397.0651756
Names & identifiers
- Preferred name
- N-(4-(9-Acridinylamino)-3-chlorophenyl)methanesulfonamide
- IUPAC
- N-[4-(acridin-9-ylamino)-3-chlorophenyl]methanesulfonamide
Names & synonyms
72738-96-6Methanesulfonamide, N-(4-(9-acridinylamino)-3-chlorophenyl)-N-(4-(9-Acridinylamino)-3-chlorophenyl)methanesulfonamideCHEMBL313853DTXSID10223041N-{4-[(ACRIDIN-9-YL)AMINO]-3-CHLOROPHENYL}METHANESULFONAMIDE
Database identifiers
- CAS
72738-96-6- PubChem CID
- 149491
- DTXSID
DTXSID10223041- ChEMBL
CHEMBL313853- Nikkaji
- J1.060.416H
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 79.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 589
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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