Basic information
- Standard SMILES
Cc1c(Cl)c(OCC(=O)NCCO)nc2sc(C(=O)NC3CC3)c(N)c12- InChIKey
MTMQLYIJIWRRTR-UHFFFAOYSA-N- Molecular formula
- C16H19ClN4O4S
- Average molar mass
- 398.9 g/mol
Names & identifiers
- Preferred name
- (3-Amino-5-chloro-2-cyclopropylcarbamoyl-4-methyl-thieno[2,3-b]pyridin-6-yloxy)-acetic acid 2-hydroxyethylamide
- IUPAC
- 3-amino-5-chloro-N-cyclopropyl-6-[2-(2-hydroxyethylamino)-2-oxoethoxy]-4-methylthieno[2,3-b]pyridine-2-carboxamide
Names & synonyms
SCHEMBL2905470MTMQLYIJIWRRTR-UHFFFAOYSA-N(3-Amino-5-chloro-2-cyclopropylcarbamoyl-4-methyl-thieno[2,3-b]pyridin-6-yloxy)-acetic acid 2-hydroxyethylamide
Database identifiers
- PubChem CID
- 57664409
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 155 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 538
Related reactions
2 records
Compound notes
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