Diethyl 5-[[2-[[5-(2,6-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetyl]amino]-3-methylthiophene-2,4-dicarboxylate
Basic information
- CAS
6241-45-8- Standard SMILES
CCOC(=O)c1sc(NC(=O)CSc2nnc(-c3c(OC)cccc3OC)o2)c(C(=O)OCC)c1C- InChIKey
NSGGUBSJCABFLX-UHFFFAOYSA-N- Molecular formula
- C23H25N3O8S2
- Average molar mass
- 535.6 g/mol
- Monoisotopic mass
- 535.10830711
Names & identifiers
- Preferred name
- Diethyl 5-[[2-[[5-(2,6-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetyl]amino]-3-methylthiophene-2,4-dicarboxylate
- IUPAC
- diethyl 5-[[2-[[5-(2,6-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetyl]amino]-3-methylthiophene-2,4-dicarboxylate
Names & synonyms
6241-45-8diethyl 5-[[2-[[5-(2,6-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetyl]amino]-3-methylthiophene-2,4-dicarboxylateDTXSID00411177Diethyl 5-(2-{[5-(2,6-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetamido)-3-methylthiophene-2,4-dicarboxylate
Database identifiers
- CAS
6241-45-8- PubChem CID
- 5222880
- DTXSID
DTXSID00411177
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 193 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 13
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 751
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…