N-(4-chloro-2-methylphenyl)-3-(3-{[(5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide
Chemical Structure Depiction of
N-(4-chloro-2-methylphenyl)-3-(3-{[(5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide
N-(4-chloro-2-methylphenyl)-3-(3-{[(5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide
Compound characteristics
| Compound ID: | J021-3290 |
| Compound Name: | N-(4-chloro-2-methylphenyl)-3-(3-{[(5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide |
| Molecular Weight: | 406.89 |
| Molecular Formula: | C17 H19 Cl N6 O2 S |
| Smiles: | CCc1nnc([nH]1)SCc1nc(CCC(Nc2ccc(cc2C)[Cl])=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 2.6939 |
| logD: | 2.3594 |
| logSw: | -3.4072 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.521 |
| InChI Key: | JWCLFTWARASTQU-UHFFFAOYSA-N |