N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{3-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{3-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}-1,3-thiazole-4-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{3-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}-1,3-thiazole-4-carboxamide
Compound characteristics
| Compound ID: | V016-1672 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{3-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 424.47 |
| Molecular Formula: | C22 H20 N2 O5 S |
| Smiles: | COc1cc(ccc1OCC=C)c1nc(cs1)C(NCc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3529 |
| logD: | 4.3529 |
| logSw: | -4.3856 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.636 |
| InChI Key: | JTWFXDZMSXTUPT-UHFFFAOYSA-N |