3-methyl-8-[(3-methylbutoxy)methyl]-3-{2-[(prop-2-en-1-yl)amino]-1,3-thiazol-4-yl}-2,7-dioxaspiro[4.4]nonane-1,6-dione
Chemical Structure Depiction of
3-methyl-8-[(3-methylbutoxy)methyl]-3-{2-[(prop-2-en-1-yl)amino]-1,3-thiazol-4-yl}-2,7-dioxaspiro[4.4]nonane-1,6-dione
3-methyl-8-[(3-methylbutoxy)methyl]-3-{2-[(prop-2-en-1-yl)amino]-1,3-thiazol-4-yl}-2,7-dioxaspiro[4.4]nonane-1,6-dione
Compound characteristics
| Compound ID: | 4159-0018 |
| Compound Name: | 3-methyl-8-[(3-methylbutoxy)methyl]-3-{2-[(prop-2-en-1-yl)amino]-1,3-thiazol-4-yl}-2,7-dioxaspiro[4.4]nonane-1,6-dione |
| Molecular Weight: | 408.52 |
| Molecular Formula: | C20 H28 N2 O5 S |
| Smiles: | CC(C)CCOCC1CC2(CC(C)(c3csc(NCC=C)n3)OC2=O)C(=O)O1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.6168 |
| logD: | 3.6168 |
| logSw: | -3.8022 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.905 |
| InChI Key: | ZODBUEYXUFSRTI-UHFFFAOYSA-N |