3-(3-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)propanamide
Chemical Structure Depiction of
3-(3-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)propanamide
3-(3-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)propanamide
Compound characteristics
| Compound ID: | J021-0022 |
| Compound Name: | 3-(3-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)propanamide |
| Molecular Weight: | 432.54 |
| Molecular Formula: | C17 H16 N6 O2 S3 |
| Smiles: | CCc1nnc(NC(CCc2nc(CSc3nc4ccccc4s3)no2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.0223 |
| logD: | 3.9355 |
| logSw: | -3.9912 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.571 |
| InChI Key: | MKCSAHMAYRCSHS-UHFFFAOYSA-N |