1-(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}benzoyl)piperidine-4-carboxamide
Chemical Structure Depiction of
1-(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}benzoyl)piperidine-4-carboxamide
1-(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}benzoyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | K248-0053 |
| Compound Name: | 1-(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}benzoyl)piperidine-4-carboxamide |
| Molecular Weight: | 422.52 |
| Molecular Formula: | C18 H22 N4 O4 S2 |
| Smiles: | C1CN(CCC1C(N)=O)C(c1ccc(cc1)NC1=N[C@@H]2CS(C[C@@H]2S1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.1028 |
| logD: | -0.1029 |
| logSw: | -2.101 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 98.049 |
| InChI Key: | RASUEEDIWLKAIZ-UHFFFAOYSA-N |