N-[3-(1,3-benzothiazol-2-yl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-2-phenylacetamide
Basic information
- CAS
6222-84-0- Standard SMILES
CN1CCc2c(sc(NC(=O)Cc3ccccc3)c2-c2nc3ccccc3s2)C1- InChIKey
XNPOFKFBIHPBFP-UHFFFAOYSA-N- Molecular formula
- C23H21N3OS2
- Average molar mass
- 419.6 g/mol
- Monoisotopic mass
- 419.11260465
Names & identifiers
- Preferred name
- N-[3-(1,3-benzothiazol-2-yl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-2-phenylacetamide
- IUPAC
- N-[3-(1,3-benzothiazol-2-yl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-2-phenylacetamide
Names & synonyms
N-[3-(1,3-benzothiazol-2-yl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-2-phenylacetamide6222-84-0N-[3-(1,3-benzothiazol-2-yl)-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl]-2-phenylacetamideOprea1_028694DTXSID10409767MFCD11984345AKOS002068821
Database identifiers
- CAS
6222-84-0- PubChem CID
- 5204495
- DTXSID
DTXSID10409767
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 584
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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