3-{[(3,4-dimethoxyphenyl)methyl]amino}-4-methyl-5-[4-(propan-2-yl)phenyl]-1H-1lambda~6~,2-thiazole-1,1-dione
Chemical Structure Depiction of
3-{[(3,4-dimethoxyphenyl)methyl]amino}-4-methyl-5-[4-(propan-2-yl)phenyl]-1H-1lambda~6~,2-thiazole-1,1-dione
3-{[(3,4-dimethoxyphenyl)methyl]amino}-4-methyl-5-[4-(propan-2-yl)phenyl]-1H-1lambda~6~,2-thiazole-1,1-dione
Compound characteristics
| Compound ID: | E013-3056 |
| Compound Name: | 3-{[(3,4-dimethoxyphenyl)methyl]amino}-4-methyl-5-[4-(propan-2-yl)phenyl]-1H-1lambda~6~,2-thiazole-1,1-dione |
| Molecular Weight: | 414.52 |
| Molecular Formula: | C22 H26 N2 O4 S |
| Smiles: | CC(C)c1ccc(cc1)C1=C(C)C(NCc2ccc(c(c2)OC)OC)=NS1(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8531 |
| logD: | 3.853 |
| logSw: | -4.0634 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.427 |
| InChI Key: | OKDNRAHZWVROMJ-UHFFFAOYSA-N |