(2Z)-2-benzylidene-5-methyl-1-oxo-1,2-dihydro-5H,11H-5,11-methano[1,3]thiazolo[2,3-d][1,3,5]benzoxadiazocine-13-carboxamide
Chemical Structure Depiction of
(2Z)-2-benzylidene-5-methyl-1-oxo-1,2-dihydro-5H,11H-5,11-methano[1,3]thiazolo[2,3-d][1,3,5]benzoxadiazocine-13-carboxamide
(2Z)-2-benzylidene-5-methyl-1-oxo-1,2-dihydro-5H,11H-5,11-methano[1,3]thiazolo[2,3-d][1,3,5]benzoxadiazocine-13-carboxamide
Compound characteristics
| Compound ID: | Y505-3283 |
| Compound Name: | (2Z)-2-benzylidene-5-methyl-1-oxo-1,2-dihydro-5H,11H-5,11-methano[1,3]thiazolo[2,3-d][1,3,5]benzoxadiazocine-13-carboxamide |
| Molecular Weight: | 391.45 |
| Molecular Formula: | C21 H17 N3 O3 S |
| Smiles: | CC12C(C(c3ccccc3O2)N2C(=N1)SC(=C/c1ccccc1)\C2=O)C(N)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.6695 |
| logD: | 2.6689 |
| logSw: | -3.1978 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.451 |
| InChI Key: | FYAXMJNYQRJAFG-UHFFFAOYSA-N |