2-{2-[3-methyl-5-oxo-1-(4-phenyl-1,3-thiazol-2-yl)-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazinyl}benzoic acid
Chemical Structure Depiction of
2-{2-[3-methyl-5-oxo-1-(4-phenyl-1,3-thiazol-2-yl)-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazinyl}benzoic acid
2-{2-[3-methyl-5-oxo-1-(4-phenyl-1,3-thiazol-2-yl)-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazinyl}benzoic acid
Compound characteristics
| Compound ID: | 1652-1171 |
| Compound Name: | 2-{2-[3-methyl-5-oxo-1-(4-phenyl-1,3-thiazol-2-yl)-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazinyl}benzoic acid |
| Molecular Weight: | 405.43 |
| Molecular Formula: | C20 H15 N5 O3 S |
| Smiles: | CC1\C(C(N(c2nc(cs2)c2ccccc2)N=1)=O)=N/Nc1ccccc1C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4988 |
| logD: | 1.9565 |
| logSw: | -5.3694 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.821 |
| InChI Key: | XGSYDQRSMJFMOB-UHFFFAOYSA-N |