2,3-Dihydro-6-Methoxy-2-(4-Methoxyphenyl)benzo[b]thiophene-3-Carboxylic Acid
Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
COc1ccc(C2Sc3cc(OC)ccc3C2C(=O)O)cc1- InChIKey
FKVGVWYXYADKDM-UHFFFAOYSA-N- Molecular formula
- C17H16O4S
- Average molar mass
- 316.4 g/mol
Names & identifiers
- Preferred name
- 2,3-Dihydro-6-Methoxy-2-(4-Methoxyphenyl)benzo[b]thiophene-3-Carboxylic Acid
- IUPAC
- 6-methoxy-2-(4-methoxyphenyl)-2,3-dihydro-1-benzothiophene-3-carboxylic acid
Names & synonyms
SCHEMBL8164173FKVGVWYXYADKDM-UHFFFAOYSA-N2,3-Dihydro-6-Methoxy-2-(4-Methoxyphenyl)benzo[b]thiophene-3-Carboxylic Acid
Database identifiers
- PubChem CID
- 15458264
Properties
Computed structural propertiesFilling in
- XLogP
- 3.2
- Topological polar surface area
- 81.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 394
Related reactions
2 records
Compound notes
Loading…