5-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]-1-methyl-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
5-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]-1-methyl-1H-pyrazole-4-carboxylic acid
5-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]-1-methyl-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | Y504-6242 |
| Compound Name: | 5-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]-1-methyl-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 332.34 |
| Molecular Formula: | C14 H12 N4 O4 S |
| Smiles: | Cn1c(C(Nc2nc3ccc(cc3s2)OC)=O)c(cn1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4223 |
| logD: | -1.7665 |
| logSw: | -2.9511 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.559 |
| InChI Key: | BCVRKKIEQLCZSP-UHFFFAOYSA-N |