5-(3-bromophenyl)-3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4-methyl-1H-1lambda~6~,2-thiazole-1,1-dione
Chemical Structure Depiction of
5-(3-bromophenyl)-3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4-methyl-1H-1lambda~6~,2-thiazole-1,1-dione
5-(3-bromophenyl)-3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4-methyl-1H-1lambda~6~,2-thiazole-1,1-dione
Compound characteristics
| Compound ID: | E013-1915 |
| Compound Name: | 5-(3-bromophenyl)-3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4-methyl-1H-1lambda~6~,2-thiazole-1,1-dione |
| Molecular Weight: | 465.36 |
| Molecular Formula: | C20 H21 Br N2 O4 S |
| Smiles: | CC1=C(c2cccc(c2)[Br])S(N=C1NCCc1ccc(c(c1)OC)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3655 |
| logD: | 3.3655 |
| logSw: | -3.6668 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.269 |
| InChI Key: | YCAQVJRIZHSJCB-UHFFFAOYSA-N |