N-[(2Z)-3-(3-butoxyphenyl)-5,5-dioxohexahydro-2H-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-ylidene]-2,2-dimethylpropanamide
Chemical Structure Depiction of
N-[(2Z)-3-(3-butoxyphenyl)-5,5-dioxohexahydro-2H-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-ylidene]-2,2-dimethylpropanamide
N-[(2Z)-3-(3-butoxyphenyl)-5,5-dioxohexahydro-2H-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-ylidene]-2,2-dimethylpropanamide
Compound characteristics
| Compound ID: | IB04-3984 |
| Compound Name: | N-[(2Z)-3-(3-butoxyphenyl)-5,5-dioxohexahydro-2H-5lambda~6~-thieno[3,4-d][1,3]thiazol-2-ylidene]-2,2-dimethylpropanamide |
| Molecular Weight: | 424.58 |
| Molecular Formula: | C20 H28 N2 O4 S2 |
| Smiles: | CCCCOc1cccc(c1)N1C2CS(CC2SC/1=N/C(C(C)(C)C)=O)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.75 |
| logD: | 3.75 |
| logSw: | -4.22 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 159.64 |
| InChI Key: | HWRLUAOOVCCYMP-UHFFFAOYSA-N |