3-{[(5-bromo-2-methoxyphenyl)methyl]amino}-4-methyl-5-[4-(propan-2-yl)phenyl]-1H-1lambda~6~,2-thiazole-1,1-dione
Chemical Structure Depiction of
3-{[(5-bromo-2-methoxyphenyl)methyl]amino}-4-methyl-5-[4-(propan-2-yl)phenyl]-1H-1lambda~6~,2-thiazole-1,1-dione
3-{[(5-bromo-2-methoxyphenyl)methyl]amino}-4-methyl-5-[4-(propan-2-yl)phenyl]-1H-1lambda~6~,2-thiazole-1,1-dione
Compound characteristics
| Compound ID: | E013-3060 |
| Compound Name: | 3-{[(5-bromo-2-methoxyphenyl)methyl]amino}-4-methyl-5-[4-(propan-2-yl)phenyl]-1H-1lambda~6~,2-thiazole-1,1-dione |
| Molecular Weight: | 463.39 |
| Molecular Formula: | C21 H23 Br N2 O3 S |
| Smiles: | CC(C)c1ccc(cc1)C1=C(C)C(NCc2cc(ccc2OC)[Br])=NS1(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1314 |
| logD: | 5.1314 |
| logSw: | -5.1636 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.797 |
| InChI Key: | CKNMUOFTCAZBFT-UHFFFAOYSA-N |