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-(3-methoxyphenyl)-N~2~-(4-methoxyphenyl)glycinamide
Chemical Structure Depiction of
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-(3-methoxyphenyl)-N~2~-(4-methoxyphenyl)glycinamide
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-(3-methoxyphenyl)-N~2~-(4-methoxyphenyl)glycinamide
Compound characteristics
| Compound ID: | C998-0365 |
| Compound Name: | 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-(3-methoxyphenyl)-N~2~-(4-methoxyphenyl)glycinamide |
| Molecular Weight: | 461.56 |
| Molecular Formula: | C21 H23 N3 O5 S2 |
| Smiles: | COc1ccc(cc1)N(CC(Nc1cccc(c1)OC)=O)C1=N[C@@H]2CS(C[C@@H]2S1)(=O)=O |
| Stereo: | RELATIVE |
| logP: | 2.916 |
| logD: | 2.916 |
| logSw: | -3.5167 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.252 |
| InChI Key: | AXLRVBQIRTZSKG-UHFFFAOYSA-N |