2-(4-{[rel-(3aR,6aR)-5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl]amino}phenyl)-N-[2-(furan-2-yl)ethyl]acetamide
Chemical Structure Depiction of
2-(4-{[rel-(3aR,6aR)-5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl]amino}phenyl)-N-[2-(furan-2-yl)ethyl]acetamide
2-(4-{[rel-(3aR,6aR)-5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl]amino}phenyl)-N-[2-(furan-2-yl)ethyl]acetamide
Compound characteristics
| Compound ID: | K248-0227 |
| Compound Name: | 2-(4-{[rel-(3aR,6aR)-5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl]amino}phenyl)-N-[2-(furan-2-yl)ethyl]acetamide |
| Molecular Weight: | 419.52 |
| Molecular Formula: | C19 H21 N3 O4 S2 |
| Smiles: | C(CNC(Cc1ccc(cc1)NC1=N[C@@H]2CS(C[C@@H]2S1)(=O)=O)=O)c1ccco1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.3246 |
| logD: | 1.3245 |
| logSw: | -2.0747 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.132 |
| InChI Key: | DNDBODWOXOLBOA-UHFFFAOYSA-N |