3-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(4-fluorophenyl)imino]-4-oxo-N-(2-phenylethyl)-1,3-thiazinane-6-carboxamide
Chemical Structure Depiction of
3-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(4-fluorophenyl)imino]-4-oxo-N-(2-phenylethyl)-1,3-thiazinane-6-carboxamide
3-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(4-fluorophenyl)imino]-4-oxo-N-(2-phenylethyl)-1,3-thiazinane-6-carboxamide
Compound characteristics
| Compound ID: | 2738-0193 |
| Compound Name: | 3-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(4-fluorophenyl)imino]-4-oxo-N-(2-phenylethyl)-1,3-thiazinane-6-carboxamide |
| Molecular Weight: | 505.57 |
| Molecular Formula: | C27 H24 F N3 O4 S |
| Smiles: | C(CNC(C1CC(N(Cc2ccc3c(c2)OCO3)/C(=N/c2ccc(cc2)F)S1)=O)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3094 |
| logD: | 4.3051 |
| logSw: | -4.3973 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.418 |
| InChI Key: | REALKJJWGHNEJP-DEOSSOPVSA-N |