Basic information
- Standard SMILES
COc1ccc(C2COCCO2)c2sc(NC(=O)CCCN(C)C)nc12- InChIKey
HTNJMSUIEMPKOI-UHFFFAOYSA-N- Molecular formula
- C18H25N3O4S
- Average molar mass
- 379.5 g/mol
Names & identifiers
- Preferred name
- (+)-4-Dimethylamino-N-(7-[1,4]dioxan-2-yl-4-methoxy-benzothiazol-2-yl)-butyramide
- IUPAC
- 4-(dimethylamino)-N-[7-(1,4-dioxan-2-yl)-4-methoxy-1,3-benzothiazol-2-yl]butanamide
Names & synonyms
SCHEMBL5566339HTNJMSUIEMPKOI-UHFFFAOYSA-N(+)-4-Dimethylamino-N-(7-[1,4]dioxan-2-yl-4-methoxy-benzothiazol-2-yl)-butyramide
Database identifiers
- PubChem CID
- 22507699
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 468
Related reactions
2 records
Compound notes
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