3-{[(5-bromo-2-methoxyphenyl)methyl]amino}-4-methyl-5-phenyl-1H-1lambda~6~,2-thiazole-1,1-dione
Chemical Structure Depiction of
3-{[(5-bromo-2-methoxyphenyl)methyl]amino}-4-methyl-5-phenyl-1H-1lambda~6~,2-thiazole-1,1-dione
3-{[(5-bromo-2-methoxyphenyl)methyl]amino}-4-methyl-5-phenyl-1H-1lambda~6~,2-thiazole-1,1-dione
Compound characteristics
| Compound ID: | E013-3387 |
| Compound Name: | 3-{[(5-bromo-2-methoxyphenyl)methyl]amino}-4-methyl-5-phenyl-1H-1lambda~6~,2-thiazole-1,1-dione |
| Molecular Weight: | 421.31 |
| Molecular Formula: | C18 H17 Br N2 O3 S |
| Smiles: | CC1=C(c2ccccc2)S(N=C1NCc1cc(ccc1OC)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6882 |
| logD: | 3.6881 |
| logSw: | -3.9563 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.797 |
| InChI Key: | GAYNQEPTGWFERS-UHFFFAOYSA-N |