3-methyl-N-(5-nitro-1,3-thiazol-2-yl)butanamide
Chemical Structure Depiction of
3-methyl-N-(5-nitro-1,3-thiazol-2-yl)butanamide
3-methyl-N-(5-nitro-1,3-thiazol-2-yl)butanamide
Compound characteristics
| Compound ID: | Y032-1287 |
| Compound Name: | 3-methyl-N-(5-nitro-1,3-thiazol-2-yl)butanamide |
| Molecular Weight: | 229.25 |
| Molecular Formula: | C8 H11 N3 O3 S |
| Smiles: | CC(C)CC(Nc1ncc([N+]([O-])=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6312 |
| logD: | 1.4656 |
| logSw: | -3.0272 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.689 |
| InChI Key: | BWLCCIHERVQBCS-UHFFFAOYSA-N |