N-[(Z)-(4-bromothiophen-2-yl)methylideneamino]-2,3-dihydrobenzo[g][1,4]benzodioxine-3-carboxamide
Basic information
- CAS
5743-70-4- Standard SMILES
O=C(N/N=C\c1cc(Br)cs1)C1COc2cc3ccccc3cc2O1- InChIKey
QLSOBSCREFZJJT-ZBKNUEDVSA-N- Molecular formula
- C18H13BrN2O3S
- Average molar mass
- 417.3 g/mol
- Monoisotopic mass
- 415.98303
Names & identifiers
- Preferred name
- N-[(Z)-(4-bromothiophen-2-yl)methylideneamino]-2,3-dihydrobenzo[g][1,4]benzodioxine-3-carboxamide
- IUPAC
- N-[(Z)-(4-bromothiophen-2-yl)methylideneamino]-2,3-dihydrobenzo[g][1,4]benzodioxine-3-carboxamide
Names & synonyms
5743-70-4N-[(Z)-(4-bromothiophen-2-yl)methylideneamino]-2,3-dihydrobenzo[g][1,4]benzodioxine-3-carboxamideN'-[(4-bromo-2-thienyl)methylene]-2,3-dihydronaphtho[2,3-b][1,4]dioxine-2-carbohydrazideAC1NSMQWDTXSID40416621N'-[(Z)-(4-Bromothiophen-2-yl)methylidene]-2,3-dihydronaphtho[2,3-b][1,4]dioxine-2-carbohydrazide
Database identifiers
- CAS
5743-70-4- PubChem CID
- 5336542
- DTXSID
DTXSID40416621
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 88.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 521
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Related reactions
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Compound notes
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