ethyl (2-{2-[(5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-1,3,4-oxadiazol-2-yl)sulfanyl]acetamido}-1,3-thiazol-4-yl)acetate
Chemical Structure Depiction of
ethyl (2-{2-[(5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-1,3,4-oxadiazol-2-yl)sulfanyl]acetamido}-1,3-thiazol-4-yl)acetate
ethyl (2-{2-[(5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-1,3,4-oxadiazol-2-yl)sulfanyl]acetamido}-1,3-thiazol-4-yl)acetate
Compound characteristics
| Compound ID: | 5400-0692 |
| Compound Name: | ethyl (2-{2-[(5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-1,3,4-oxadiazol-2-yl)sulfanyl]acetamido}-1,3-thiazol-4-yl)acetate |
| Molecular Weight: | 480.58 |
| Molecular Formula: | C18 H20 N6 O4 S3 |
| Smiles: | CCOC(Cc1csc(NC(CSc2nnc(CSc3nc(C)cc(C)n3)o2)=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3068 |
| logD: | 2.3049 |
| logSw: | -2.7266 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 100.486 |
| InChI Key: | SOXNYRSFLYJJQY-UHFFFAOYSA-N |