2-[(2H-1,3-benzodioxol-5-yl)imino]-3-ethyl-N-(4-iodophenyl)-4-oxo-1,3-thiazinane-6-carboxamide
Chemical Structure Depiction of
2-[(2H-1,3-benzodioxol-5-yl)imino]-3-ethyl-N-(4-iodophenyl)-4-oxo-1,3-thiazinane-6-carboxamide
2-[(2H-1,3-benzodioxol-5-yl)imino]-3-ethyl-N-(4-iodophenyl)-4-oxo-1,3-thiazinane-6-carboxamide
Compound characteristics
| Compound ID: | 8012-2322 |
| Compound Name: | 2-[(2H-1,3-benzodioxol-5-yl)imino]-3-ethyl-N-(4-iodophenyl)-4-oxo-1,3-thiazinane-6-carboxamide |
| Molecular Weight: | 523.35 |
| Molecular Formula: | C20 H18 I N3 O4 S |
| Smiles: | CCN1\C(=N/c2ccc3c(c2)OCO3)SC(CC1=O)C(Nc1ccc(cc1)I)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7626 |
| logD: | 4.7617 |
| logSw: | -4.4968 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.25 |
| InChI Key: | KKLLGKQEXSOYID-KRWDZBQOSA-N |