4-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-1-methyl-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
4-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-1-methyl-1H-pyrazole-3-carboxylic acid
4-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-1-methyl-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | Y502-6913 |
| Compound Name: | 4-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-1-methyl-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 370.21 |
| Molecular Formula: | C14 H9 Cl2 N3 O3 S |
| Smiles: | Cn1cc(c(C(O)=O)n1)NC(c1c(c2ccc(cc2s1)[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.7296 |
| logD: | -1.8979 |
| logSw: | -3.464 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.142 |
| InChI Key: | YUGFJMZMFPJNLK-UHFFFAOYSA-N |