2-[(2H-1,3-benzodioxol-5-yl)imino]-3-ethyl-N-[4-(hexyloxy)phenyl]-4-oxo-1,3-thiazinane-6-carboxamide
Chemical Structure Depiction of
2-[(2H-1,3-benzodioxol-5-yl)imino]-3-ethyl-N-[4-(hexyloxy)phenyl]-4-oxo-1,3-thiazinane-6-carboxamide
2-[(2H-1,3-benzodioxol-5-yl)imino]-3-ethyl-N-[4-(hexyloxy)phenyl]-4-oxo-1,3-thiazinane-6-carboxamide
Compound characteristics
| Compound ID: | 4514-2056 |
| Compound Name: | 2-[(2H-1,3-benzodioxol-5-yl)imino]-3-ethyl-N-[4-(hexyloxy)phenyl]-4-oxo-1,3-thiazinane-6-carboxamide |
| Molecular Weight: | 497.61 |
| Molecular Formula: | C26 H31 N3 O5 S |
| Smiles: | CCCCCCOc1ccc(cc1)NC(C1CC(N(CC)/C(=N/c2ccc3c(c2)OCO3)S1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0304 |
| logD: | 6.0298 |
| logSw: | -5.2162 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.668 |
| InChI Key: | QUWLXSBJMJFZJB-QHCPKHFHSA-N |