D 272
benzenesulfonate;trimethyl(2-pyrido[3,2-b][1,4]benzothiazin-10-ylpropyl)azanium
| Molecular Formula | C23H27N3O3S2 |
|---|---|
| Molecular Weight | 457.6 g/mol |
| Topological Polar Surface Area | 107.0 A2 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 457.14938 |
| Heavy Atoms | 31 |
| Complexity | 525.0 |
Chemical Identifiers
| CAS Number | 66827-20-1 |
|---|---|
| SMILES | CC(C[N+](C)(C)C)N1C2=CC=CC=C2SC3=C1N=CC=C3.C1=CC=C(C=C1)S(=O)(=O)[O-] |
| InChIKey | BEVGQIJCLIQRRX-UHFFFAOYSA-M |
📖 Product Overview
D 272 (CAS: 66827-20-1) is a chemical compound with molecular formula C23H27N3O3S2 and molecular weight 457.6 g/mol. Its IUPAC systematic name is benzenesulfonate;trimethyl(2-pyrido[3,2-b][1,4]benzothiazin-10-ylpropyl)azanium.
BEVGQIJCLIQRRX-UHFFFAOYSA-M.
SMILES: CC(C[N+](C)(C)C)N1C2=CC=CC=C2SC3=C1N=CC=C3.C1=CC=C(C=C1)S(=O)(=O)[O-].
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