3-(4-Methoxyphenyl)-8H-thieno[2,3-b]pyrrolizin-8-one
Basic information
- CAS
156274-19-0- Standard SMILES
COc1ccc(-c2csc3c2-n2cccc2C3=O)cc1- InChIKey
STBQKICVQXGVLM-UHFFFAOYSA-N- Molecular formula
- C16H11NO2S
- Average molar mass
- 281.3 g/mol
- Monoisotopic mass
- 281.05104977
Names & identifiers
- Preferred name
- 3-(4-Methoxyphenyl)-8H-thieno[2,3-b]pyrrolizin-8-one
- IUPAC
- 3-(4-methoxyphenyl)thieno[2,3-b]pyrrolizin-8-one
Names & synonyms
3-(4-Methoxyphenyl)-8H-thieno[2,3-b]pyrrolizin-8-one156274-19-0NSC6766933-(4-methoxyphenyl)thieno[2,3-b]pyrrolizin-8-oneMR 16924CHEMBL35955SCHEMBL6999102SCHEMBL7003322DTXSID10327674STBQKICVQXGVLM-UHFFFAOYSA-NCCG-365848H-Thieno[2, 3-(4-methoxyphenyl)-
Show more names
NCI60_0271763-(4-methoxyphenyl)-4H-thieno[2,3-b]pyrrolizin-8-one3-(4-methoxyphenyl)-8H-thieno[2.3-b]pyrrolizin-8-one
Database identifiers
- CAS
156274-19-0- PubChem CID
- 385455
- DTXSID
DTXSID10327674- ChEMBL
CHEMBL35955- Nikkaji
- J1.574.794C
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 59.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 394
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
1 records
Compound notes
Loading…