Basic information
- Standard SMILES
COc1ccc2ncc(F)c(CCN3CCC(C(C)(C)NCc4ccc5c(n4)NC(=O)CS5)C3)c2n1- InChIKey
FXLONCJBIWCVAE-UHFFFAOYSA-N- Molecular formula
- C26H31FN6O2S
- Average molar mass
- 510.6 g/mol
- Monoisotopic mass
- 510.22132359
Names & identifiers
- Preferred name
- 6-[[2-[1-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]pyrrolidin-3-yl]propan-2-ylamino]methyl]-4H-pyrido[3,2-b][1,4]thiazin-3-one
- IUPAC
- 6-[[2-[1-[2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)ethyl]pyrrolidin-3-yl]propan-2-ylamino]methyl]-4H-pyrido[3,2-b][1,4]thiazin-3-one
Database identifiers
- PubChem CID
- 73061237
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 118 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 8
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 762
Related reactions
1 records
Compound notes
Loading…