N-[(4-chlorophenyl)methyl]-2-({4-methyl-5-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-2-({4-methyl-5-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
N-[(4-chlorophenyl)methyl]-2-({4-methyl-5-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | L850-1652 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-2-({4-methyl-5-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide |
| Molecular Weight: | 454.94 |
| Molecular Formula: | C21 H19 Cl N6 O2 S |
| Smiles: | Cc1ccc(cc1)c1nc(c2nnc(n2C)SCC(NCc2ccc(cc2)[Cl])=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.188 |
| logD: | 4.188 |
| logSw: | -4.5238 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.2 |
| InChI Key: | WMIOUHNYOKGFAP-UHFFFAOYSA-N |