Basic information
- Standard SMILES
CNC(=O)N1CC[C@@]2(C1)CN(C(=O)Nc1ncc(F)s1)c1ccc(Cl)cc12- InChIKey
SMGNGENAAFQCMC-QGZVFWFLSA-N- Molecular formula
- C17H17ClFN5O2S
- Average molar mass
- 409.9 g/mol
- Monoisotopic mass
- 409.0775518
Names & identifiers
- Preferred name
- (R)-5-chloro-N1-(5-fluorothiazol-2-yl)-N1'-methylspiro[indoline-3,3'-pyrrolidine]-1,1'-dicarboxamide
- IUPAC
- (3R)-5-chloro-1-N-(5-fluoro-1,3-thiazol-2-yl)-1-N'-methylspiro[2H-indole-3,3'-pyrrolidine]-1,1'-dicarboxamide
Names & synonyms
SCHEMBL16086245SMGNGENAAFQCMC-QGZVFWFLSA-N(R)-5-chloro-N1-(5-fluorothiazol-2-yl)-N1'-methylspiro[indoline-3,3'-pyrrolidine]-1,1'-dicarboxamide
Database identifiers
- PubChem CID
- 90449367
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 106 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 616
Related reactions
1 records
Compound notes
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