Basic information
- Standard SMILES
NC1=NC2(c3cc(NC(=O)c4cnc(CF)cn4)ccc3F)COC(C(F)(F)F)C2CS1- InChIKey
XHNXAPUTQFTIOC-UHFFFAOYSA-N- Molecular formula
- C19H16F5N5O2S
- Average molar mass
- 473.4 g/mol
- Monoisotopic mass
- 473.09448675
Names & identifiers
- Preferred name
- N-[3-[2-amino-5-(trifluoromethyl)-4,4a,5,7-tetrahydrofuro[3,4-d][1,3]thiazin-7a-yl]-4-fluorophenyl]-5-(fluoromethyl)pyrazine-2-carboxamide
- IUPAC
- N-[3-[2-amino-5-(trifluoromethyl)-4,4a,5,7-tetrahydrofuro[3,4-d][1,3]thiazin-7a-yl]-4-fluorophenyl]-5-(fluoromethyl)pyrazine-2-carboxamide
Names & synonyms
SCHEMBL15710673
Database identifiers
- PubChem CID
- 77977324
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 128 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 4
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 743
Related reactions
1 records
Compound notes
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