3-chloro-N-[4-(3,5-dimethyl-1H-pyrazol-1-yl)phenyl]-6-methyl-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
3-chloro-N-[4-(3,5-dimethyl-1H-pyrazol-1-yl)phenyl]-6-methyl-1-benzothiophene-2-carboxamide
3-chloro-N-[4-(3,5-dimethyl-1H-pyrazol-1-yl)phenyl]-6-methyl-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | Y501-3186 |
| Compound Name: | 3-chloro-N-[4-(3,5-dimethyl-1H-pyrazol-1-yl)phenyl]-6-methyl-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 395.91 |
| Molecular Formula: | C21 H18 Cl N3 O S |
| Smiles: | Cc1ccc2c(c(C(Nc3ccc(cc3)n3c(C)cc(C)n3)=O)sc2c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.1655 |
| logD: | 5.1653 |
| logSw: | -5.595 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.948 |
| InChI Key: | VDZZAXKWHQUMBP-UHFFFAOYSA-N |