2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide
Chemical Structure Depiction of
2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide
2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide
Compound characteristics
| Compound ID: | Y500-5715 |
| Compound Name: | 2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide |
| Molecular Weight: | 441.89 |
| Molecular Formula: | C20 H16 Cl N5 O3 S |
| Smiles: | Cc1ccc2c(c1)sc(c1ccc(cc1)NC(Cn1c(C)c(c(n1)[N+]([O-])=O)[Cl])=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 4.571 |
| logD: | 4.571 |
| logSw: | -4.8849 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.856 |
| InChI Key: | WWIHXCOXPPEJJU-UHFFFAOYSA-N |