3-(3-{[(5-chloro-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide
Chemical Structure Depiction of
3-(3-{[(5-chloro-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide
3-(3-{[(5-chloro-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide
Compound characteristics
| Compound ID: | J021-3342 |
| Compound Name: | 3-(3-{[(5-chloro-1H-benzimidazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide |
| Molecular Weight: | 467.98 |
| Molecular Formula: | C16 H14 Cl N7 O2 S3 |
| Smiles: | CSc1nnc(NC(CCc2nc(CSc3nc4cc(ccc4[nH]3)[Cl])no2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.7243 |
| logD: | 3.624 |
| logSw: | -4.1973 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.369 |
| InChI Key: | WONJCVPKEDSXGL-UHFFFAOYSA-N |