Methanesulfonamide, N-(4-(benzo(b)(1,7)phenanthrolin-7-ylamino)-3-(dimethylamino)phenyl)-, trihydrochloride
Basic information
- CAS
111880-38-7- Standard SMILES
CN(C)c1cc(NS(C)(=O)=O)ccc1Nc1c2ccccc2nc2c1ccc1ncccc12.Cl.Cl.Cl- InChIKey
KTSFLGFVKMRPMX-UHFFFAOYSA-N- Molecular formula
- C25H26Cl3N5O2S
- Average molar mass
- 566.9 g/mol
- Monoisotopic mass
- 565.087279
Names & identifiers
- Preferred name
- Methanesulfonamide, N-(4-(benzo(b)(1,7)phenanthrolin-7-ylamino)-3-(dimethylamino)phenyl)-, trihydrochloride
- IUPAC
- N-[4-(benzo[b][1,7]phenanthrolin-7-ylamino)-3-(dimethylamino)phenyl]methanesulfonamide;trihydrochloride
Names & synonyms
111880-38-7Methanesulfonamide, N-(4-(benzo(b)(1,7)phenanthrolin-7-ylamino)-3-(dimethylamino)phenyl)-, trihydrochlorideDTXSID40149760N-{4-[(Benzo[b][1,7]phenanthrolin-7-yl)amino]-3-(dimethylamino)phenyl}methanesulfonamide--hydrogen chloride (1/3)
Database identifiers
- CAS
111880-38-7- PubChem CID
- 183371
- DTXSID
DTXSID40149760
Properties
Computed structural properties
- Topological polar surface area
- 95.6 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 771
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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