Basic information
- Standard SMILES
CO[C@H]1CCN(C(=O)c2cc3nccc(Nc4ccc5[nH]c(C)c(C)c5c4)c3s2)C1- InChIKey
IKYWZGMSPJRQLP-INIZCTEOSA-N- Molecular formula
- C23H24N4O2S
- Average molar mass
- 420.5 g/mol
Names & identifiers
- Preferred name
- (3S)-[7-(2,3-Dimethyl-1H-indol-5-ylamino)-thieno[3,2-b]pyridin-2-yl]-(3-methoxy-pyrrolidin-1-yl)-methanone
- IUPAC
- [7-[(2,3-dimethyl-1H-indol-5-yl)amino]thieno[3,2-b]pyridin-2-yl]-[(3S)-3-methoxypyrrolidin-1-yl]methanone
Names & synonyms
SCHEMBL6304770IKYWZGMSPJRQLP-INIZCTEOSA-N(3S)-[7-(2,3-Dimethyl-1H-indol-5-ylamino)-thieno[3,2-b]pyridin-2-yl]-(3-methoxy-pyrrolidin-1-yl)-methanone
Database identifiers
- PubChem CID
- 23401169
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 98.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 636
Related reactions
1 records
Compound notes
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