5-{[4-(1,3-benzothiazol-2-yl)phenyl]carbamoyl}-1-methyl-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
5-{[4-(1,3-benzothiazol-2-yl)phenyl]carbamoyl}-1-methyl-1H-pyrazole-4-carboxylic acid
5-{[4-(1,3-benzothiazol-2-yl)phenyl]carbamoyl}-1-methyl-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | Y504-8466 |
| Compound Name: | 5-{[4-(1,3-benzothiazol-2-yl)phenyl]carbamoyl}-1-methyl-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 378.41 |
| Molecular Formula: | C19 H14 N4 O3 S |
| Smiles: | Cn1c(C(Nc2ccc(cc2)c2nc3ccccc3s2)=O)c(cn1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5205 |
| logD: | -0.6683 |
| logSw: | -3.7536 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.702 |
| InChI Key: | WRTLXIGPBISHTD-UHFFFAOYSA-N |