DB-053662
bis(but-2-enedioic acid);10-[3-(4-methylpiperazin-1-yl)propyl]-2-(trifluoromethyl)phenothiazine
CAS: 605-75-4
| Molecular Formula | C29H32F3N3O8S |
|---|---|
| Molecular Weight | 639.1862 g/mol |
| LogP | 4.3692 |
| Topological Polar Surface Area | 184.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 8 |
| Exact Mass | 639.1862 |
| Monoisotopic Mass | 639.1862 |
| Heavy Atoms | 44 |
| Complexity | 629.0 |
Chemical Identifiers
| CAS Number | 605-75-4 |
|---|---|
| SMILES | CN1CCN(CC1)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F.C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O |
| InChIKey | WTMXVVQBBRYSLL-UHFFFAOYSA-N |
Product Overview
DB-053662 (CAS 605-75-4), with molecular formula C29H32F3N3O8S and molecular weight 639.1862 g/mol. IUPAC: bis(but-2-enedioic acid);10-[3-(4-methylpiperazin-1-yl)propyl]-2-(trifluoromethyl)phenothiazine.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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