Basic information
- Standard SMILES
COC(=O)c1ccc(C(=O)NCCNc2ccccn2)s1- InChIKey
GJERTRMFMYUKEW-UHFFFAOYSA-N- Molecular formula
- C14H15N3O3S
- Average molar mass
- 305.35 g/mol
Names & identifiers
- Preferred name
- 5-[2-(Pyridin-2-ylamino)-ethylcarbamoyl]-thiophene-2-carboxylic acid methyl ester
- IUPAC
- methyl 5-[2-(pyridin-2-ylamino)ethylcarbamoyl]thiophene-2-carboxylate
Names & synonyms
SCHEMBL6495007GJERTRMFMYUKEW-UHFFFAOYSA-N5-[2-(Pyridin-2-ylamino)-ethylcarbamoyl]-thiophene-2-carboxylic acid methyl ester
Database identifiers
- PubChem CID
- 23398273
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 367
Related reactions
2 records
Compound notes
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