ethyl 3-{[5-({[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropanoate
Chemical Structure Depiction of
ethyl 3-{[5-({[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropanoate
ethyl 3-{[5-({[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropanoate
Compound characteristics
| Compound ID: | L790-0087 |
| Compound Name: | ethyl 3-{[5-({[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropanoate |
| Molecular Weight: | 419.48 |
| Molecular Formula: | C17 H17 N5 O4 S2 |
| Smiles: | CCOC(CC(Nc1nnc(SCc2nnc(c3ccccc3C)o2)s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7274 |
| logD: | 2.7253 |
| logSw: | -3.3257 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.362 |
| InChI Key: | YUFYPKAPPMVSMV-UHFFFAOYSA-N |