2-[4-chloro-3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]-N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]propanamide
Chemical Structure Depiction of
2-[4-chloro-3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]-N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]propanamide
2-[4-chloro-3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]-N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]propanamide
Compound characteristics
| Compound ID: | Y502-6104 |
| Compound Name: | 2-[4-chloro-3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]-N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]propanamide |
| Molecular Weight: | 448.9 |
| Molecular Formula: | C16 H15 Cl F2 N4 O3 S2 |
| Smiles: | CC(C(Nc1nc2ccc(cc2s1)S(C)(=O)=O)=O)n1c(C)c(c(C(F)F)n1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4803 |
| logD: | 2.4799 |
| logSw: | -3.8968 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.675 |
| InChI Key: | QPASVPAUQXUUMD-QMMMGPOBSA-N |