2-{5-amino-4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)-1H-pyrazol-1-yl}-N-(4-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-{5-amino-4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)-1H-pyrazol-1-yl}-N-(4-methoxyphenyl)acetamide
2-{5-amino-4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)-1H-pyrazol-1-yl}-N-(4-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | F071-0528 |
| Compound Name: | 2-{5-amino-4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-3-(methylsulfanyl)-1H-pyrazol-1-yl}-N-(4-methoxyphenyl)acetamide |
| Molecular Weight: | 470.94 |
| Molecular Formula: | C21 H19 Cl N6 O3 S |
| Smiles: | COc1ccc(cc1)NC(Cn1c(c(c(n1)SC)c1nc(c2ccc(cc2)[Cl])no1)N)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3617 |
| logD: | 4.3617 |
| logSw: | -4.9246 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 95.425 |
| InChI Key: | BQOIPVGPDAACQD-UHFFFAOYSA-N |