4-{2-cyano-3-oxo-3-[(5-piperidino-1,3,4-thiadiazol-2-yl)amino]-1-propenyl}-2-ethoxyphenyl 2-furoate
Chemical Structure Depiction of
4-{2-cyano-3-oxo-3-[(5-piperidino-1,3,4-thiadiazol-2-yl)amino]-1-propenyl}-2-ethoxyphenyl 2-furoate
4-{2-cyano-3-oxo-3-[(5-piperidino-1,3,4-thiadiazol-2-yl)amino]-1-propenyl}-2-ethoxyphenyl 2-furoate
Compound characteristics
| Compound ID: | C726-1376 |
| Compound Name: | 4-{2-cyano-3-oxo-3-[(5-piperidino-1,3,4-thiadiazol-2-yl)amino]-1-propenyl}-2-ethoxyphenyl 2-furoate |
| Molecular Weight: | 493.54 |
| Molecular Formula: | C24 H23 N5 O5 S |
| Smiles: | CCOc1cc(/C=C(/C#N)C(Nc2nnc(N3CCCCC3)s2)=O)ccc1OC(c1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.16 |
| logD: | 4 |
| logSw: | -4.89 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 190.9 |
| InChI Key: | ZTSWBWWCFBCZBI-UHFFFAOYSA-N |