N-(1,3-benzothiazol-2-yl)-2-(5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide
Chemical Structure Depiction of
N-(1,3-benzothiazol-2-yl)-2-(5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide
N-(1,3-benzothiazol-2-yl)-2-(5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide
Compound characteristics
| Compound ID: | 8016-6451 |
| Compound Name: | N-(1,3-benzothiazol-2-yl)-2-(5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide |
| Molecular Weight: | 317.32 |
| Molecular Formula: | C13 H11 N5 O3 S |
| Smiles: | Cc1cc(nn1CC(Nc1nc2ccccc2s1)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.2104 |
| logD: | 2.2103 |
| logSw: | -2.8504 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.923 |
| InChI Key: | MJTRPBCXRPWSGJ-UHFFFAOYSA-N |