methyl 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
methyl 3-{[5-({[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropanoate
methyl 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: | L790-0106 |
| Compound Name: | methyl 3-{[5-({[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropanoate |
| Molecular Weight: | 405.45 |
| Molecular Formula: | C16 H15 N5 O4 S2 |
| Smiles: | Cc1ccccc1c1nnc(CSc2nnc(NC(CC(=O)OC)=O)s2)o1 |
| Stereo: | ACHIRAL |
| logP: | 2.2748 |
| logD: | 2.2727 |
| logSw: | -2.9117 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.782 |
| InChI Key: | VPRMZLISSUYDGB-UHFFFAOYSA-N |