methyl 4-{2-[4-phenyl-3-(thiomorpholin-4-yl)-1H-pyrazol-1-yl]acetamido}benzoate
Chemical Structure Depiction of
methyl 4-{2-[4-phenyl-3-(thiomorpholin-4-yl)-1H-pyrazol-1-yl]acetamido}benzoate
methyl 4-{2-[4-phenyl-3-(thiomorpholin-4-yl)-1H-pyrazol-1-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | M148-1142 |
| Compound Name: | methyl 4-{2-[4-phenyl-3-(thiomorpholin-4-yl)-1H-pyrazol-1-yl]acetamido}benzoate |
| Molecular Weight: | 436.53 |
| Molecular Formula: | C23 H24 N4 O3 S |
| Smiles: | COC(c1ccc(cc1)NC(Cn1cc(c2ccccc2)c(n1)N1CCSCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.301 |
| logD: | 4.3009 |
| logSw: | -4.0826 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.957 |
| InChI Key: | UWSRIWSFAVIJHL-UHFFFAOYSA-N |