ethyl 4-[(5-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)amino]-4-oxobutanoate
Chemical Structure Depiction of
ethyl 4-[(5-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)amino]-4-oxobutanoate
ethyl 4-[(5-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)amino]-4-oxobutanoate
Compound characteristics
| Compound ID: | V009-0561 |
| Compound Name: | ethyl 4-[(5-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)amino]-4-oxobutanoate |
| Molecular Weight: | 409.48 |
| Molecular Formula: | C17 H19 N3 O5 S2 |
| Salt: | not_available |
| Smiles: | CCOC(CCC(Nc1nnc(SCC(c2ccc(cc2)OC)=O)s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6842 |
| logD: | 2.6815 |
| logSw: | -3.0375 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.972 |
| InChI Key: | JHGPFAJANNBFME-UHFFFAOYSA-N |