methyl 2-[2-(4-iodo-1H-pyrazol-1-yl)acetamido]benzoate
Chemical Structure Depiction of
methyl 2-[2-(4-iodo-1H-pyrazol-1-yl)acetamido]benzoate
methyl 2-[2-(4-iodo-1H-pyrazol-1-yl)acetamido]benzoate
Compound characteristics
| Compound ID: | 8017-0377 |
| Compound Name: | methyl 2-[2-(4-iodo-1H-pyrazol-1-yl)acetamido]benzoate |
| Molecular Weight: | 385.16 |
| Molecular Formula: | C13 H12 I N3 O3 |
| Smiles: | COC(c1ccccc1NC(Cn1cc(cn1)I)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3036 |
| logD: | 2.2855 |
| logSw: | -2.9425 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.369 |
| InChI Key: | YFXNPOZMGUOFJN-UHFFFAOYSA-N |