5-amino-1-(4-chlorobenzene-1-sulfonyl)-1H-pyrazol-3-yl 3,4-dimethylbenzoate
Chemical Structure Depiction of
5-amino-1-(4-chlorobenzene-1-sulfonyl)-1H-pyrazol-3-yl 3,4-dimethylbenzoate
5-amino-1-(4-chlorobenzene-1-sulfonyl)-1H-pyrazol-3-yl 3,4-dimethylbenzoate
Compound characteristics
| Compound ID: | C050-0119 |
| Compound Name: | 5-amino-1-(4-chlorobenzene-1-sulfonyl)-1H-pyrazol-3-yl 3,4-dimethylbenzoate |
| Molecular Weight: | 405.86 |
| Molecular Formula: | C18 H16 Cl N3 O4 S |
| Smiles: | Cc1ccc(cc1C)C(=O)Oc1cc(N)n(n1)S(c1ccc(cc1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8056 |
| logD: | 3.8056 |
| logSw: | -4.5251 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.745 |
| InChI Key: | WUKGGWRFRLCVNK-UHFFFAOYSA-N |