N-[(2RS)-butan-2-yl]-2-(4-{[(3aSR,6aSR)-5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl]amino}phenyl)acetamide
Chemical Structure Depiction of
N-[(2RS)-butan-2-yl]-2-(4-{[(3aSR,6aSR)-5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl]amino}phenyl)acetamide
N-[(2RS)-butan-2-yl]-2-(4-{[(3aSR,6aSR)-5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl]amino}phenyl)acetamide
Compound characteristics
| Compound ID: | C685-0346 |
| Compound Name: | N-[(2RS)-butan-2-yl]-2-(4-{[(3aSR,6aSR)-5,5-dioxo-4,5,6,6a-tetrahydro-3aH-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-yl]amino}phenyl)acetamide |
| Molecular Weight: | 381.51 |
| Molecular Formula: | C17 H23 N3 O3 S2 |
| Smiles: | CC[C@H](C)NC(Cc1ccc(cc1)NC1=N[C@@H]2CS(C[C@@H]2S1)(=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.5305 |
| logD: | 1.5304 |
| logSw: | -2.3627 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.254 |
| InChI Key: | KINAEKHCDDHOSL-QGLTVNCISA-N |