ethyl 4-({5-[(4-ethoxy-4-oxobutyl)sulfanyl]-1,3,4-thiadiazol-2-yl}amino)-4-oxobutanoate
Chemical Structure Depiction of
ethyl 4-({5-[(4-ethoxy-4-oxobutyl)sulfanyl]-1,3,4-thiadiazol-2-yl}amino)-4-oxobutanoate
ethyl 4-({5-[(4-ethoxy-4-oxobutyl)sulfanyl]-1,3,4-thiadiazol-2-yl}amino)-4-oxobutanoate
Compound characteristics
| Compound ID: | V004-0823 |
| Compound Name: | ethyl 4-({5-[(4-ethoxy-4-oxobutyl)sulfanyl]-1,3,4-thiadiazol-2-yl}amino)-4-oxobutanoate |
| Molecular Weight: | 375.46 |
| Molecular Formula: | C14 H21 N3 O5 S2 |
| Salt: | not_available |
| Smiles: | CCOC(CCCSc1nnc(NC(CCC(=O)OCC)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2571 |
| logD: | 2.2521 |
| logSw: | -2.5383 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.611 |
| InChI Key: | ZERDWORFKCPWCC-UHFFFAOYSA-N |