4-{2-cyano-3-[(5-morpholino-1,3,4-thiadiazol-2-yl)amino]-3-oxo-1-propenyl}-2-ethoxyphenyl 2-furoate
Chemical Structure Depiction of
4-{2-cyano-3-[(5-morpholino-1,3,4-thiadiazol-2-yl)amino]-3-oxo-1-propenyl}-2-ethoxyphenyl 2-furoate
4-{2-cyano-3-[(5-morpholino-1,3,4-thiadiazol-2-yl)amino]-3-oxo-1-propenyl}-2-ethoxyphenyl 2-furoate
Compound characteristics
| Compound ID: | C726-2191 |
| Compound Name: | 4-{2-cyano-3-[(5-morpholino-1,3,4-thiadiazol-2-yl)amino]-3-oxo-1-propenyl}-2-ethoxyphenyl 2-furoate |
| Molecular Weight: | 495.51 |
| Molecular Formula: | C23 H21 N5 O6 S |
| Smiles: | CCOc1cc(/C=C(/C#N)C(Nc2nnc(N3CCOCC3)s2)=O)ccc1OC(c1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 3 |
| logD: | 2.84 |
| logSw: | -3.79 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 207.9 |
| InChI Key: | JFBPIAXXFQCTTE-UHFFFAOYSA-N |