N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-1-phenyl-3-(propan-2-yl)-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-1-phenyl-3-(propan-2-yl)-1H-pyrazole-5-carboxamide
N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-1-phenyl-3-(propan-2-yl)-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y044-1836 |
| Compound Name: | N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-1-phenyl-3-(propan-2-yl)-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 440.54 |
| Molecular Formula: | C21 H20 N4 O3 S2 |
| Smiles: | CC(C)c1cc(C(Nc2nc3ccc(cc3s2)S(C)(=O)=O)=O)n(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.8898 |
| logD: | 3.8897 |
| logSw: | -3.9611 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.935 |
| InChI Key: | TZHJIADGLBZMIQ-UHFFFAOYSA-N |