N-[3-cyano-4-methyl-1,1-dioxo-5-(piperidine-1-carbonyl)-1H-1lambda~6~-thiophen-2-yl]-2-(1,1-dioxo-1lambda~6~-thiolan-3-yl)acetamide
Chemical Structure Depiction of
N-[3-cyano-4-methyl-1,1-dioxo-5-(piperidine-1-carbonyl)-1H-1lambda~6~-thiophen-2-yl]-2-(1,1-dioxo-1lambda~6~-thiolan-3-yl)acetamide
N-[3-cyano-4-methyl-1,1-dioxo-5-(piperidine-1-carbonyl)-1H-1lambda~6~-thiophen-2-yl]-2-(1,1-dioxo-1lambda~6~-thiolan-3-yl)acetamide
Compound characteristics
| Compound ID: | 8013-4104 |
| Compound Name: | N-[3-cyano-4-methyl-1,1-dioxo-5-(piperidine-1-carbonyl)-1H-1lambda~6~-thiophen-2-yl]-2-(1,1-dioxo-1lambda~6~-thiolan-3-yl)acetamide |
| Molecular Weight: | 441.52 |
| Molecular Formula: | C18 H23 N3 O6 S2 |
| Smiles: | CC1C(C#N)=C(NC(CC2CCS(C2)(=O)=O)=O)S(C=1C(N1CCCCC1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.3738 |
| logD: | -1.731 |
| logSw: | -1.811 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 114.417 |
| InChI Key: | NZGFXKCORBTGAX-CYBMUJFWSA-N |