3-(3-{[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(1,3,4-thiadiazol-2-yl)propanamide
Chemical Structure Depiction of
3-(3-{[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(1,3,4-thiadiazol-2-yl)propanamide
3-(3-{[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(1,3,4-thiadiazol-2-yl)propanamide
Compound characteristics
| Compound ID: | J021-0286 |
| Compound Name: | 3-(3-{[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(1,3,4-thiadiazol-2-yl)propanamide |
| Molecular Weight: | 422.87 |
| Molecular Formula: | C15 H11 Cl N6 O3 S2 |
| Smiles: | C(Cc1nc(CSc2nc3cc(ccc3o2)[Cl])no1)C(Nc1nncs1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8362 |
| logD: | 2.8279 |
| logSw: | -3.584 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.689 |
| InChI Key: | KYYSCOBKBYQQDG-UHFFFAOYSA-N |