N-(5-chloro-2-methoxyphenyl)-N~2~-[rel-(3aR,6aR)-5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl]-N~2~-(4-ethoxyphenyl)glycinamide
Chemical Structure Depiction of
N-(5-chloro-2-methoxyphenyl)-N~2~-[rel-(3aR,6aR)-5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl]-N~2~-(4-ethoxyphenyl)glycinamide
N-(5-chloro-2-methoxyphenyl)-N~2~-[rel-(3aR,6aR)-5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl]-N~2~-(4-ethoxyphenyl)glycinamide
Compound characteristics
| Compound ID: | K248-0268 |
| Compound Name: | N-(5-chloro-2-methoxyphenyl)-N~2~-[rel-(3aR,6aR)-5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl]-N~2~-(4-ethoxyphenyl)glycinamide |
| Molecular Weight: | 510.03 |
| Molecular Formula: | C22 H24 Cl N3 O5 S2 |
| Smiles: | CCOc1ccc(cc1)N(CC(Nc1cc(ccc1OC)[Cl])=O)C1=N[C@@H]2CS(C[C@@H]2S1)(=O)=O |
| Stereo: | RELATIVE |
| logP: | 3.4891 |
| logD: | 3.4823 |
| logSw: | -3.836 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.221 |
| InChI Key: | JOZIDBBUTPYTAG-UHFFFAOYSA-N |