Basic information
- Standard SMILES
Cc1nc(N2CC[C@@H](N3CCC[C@@H]3C)C2)ccc1NC(=O)c1cccs1- InChIKey
AOTOJZLDIIBKFC-GOEBONIOSA-N- Molecular formula
- C20H26N4OS
- Average molar mass
- 370.5 g/mol
Names & identifiers
- Preferred name
- Thiophene-2-carboxylic acid [2-methyl-6-((2S,3'R)-2-methyl-[1,3']bipyrrolidinyl-1'-yl)-pyridin-3-yl]-amide
- IUPAC
- N-[2-methyl-6-[(3R)-3-[(2S)-2-methylpyrrolidin-1-yl]pyrrolidin-1-yl]-3-pyridinyl]thiophene-2-carboxamide
Names & synonyms
SCHEMBL12186258AOTOJZLDIIBKFC-GOEBONIOSA-NThiophene-2-carboxylic acid [2-methyl-6-((2S,3'R)-2-methyl-[1,3']bipyrrolidinyl-1'-yl)-pyridin-3-yl]-amide
Database identifiers
- PubChem CID
- 54597155
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 504
Related reactions
1 records
Compound notes
Loading…