N-(1,3-benzothiazol-2-yl)-4-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)butanamide
Chemical Structure Depiction of
N-(1,3-benzothiazol-2-yl)-4-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)butanamide
N-(1,3-benzothiazol-2-yl)-4-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)butanamide
Compound characteristics
| Compound ID: | 8018-4204 |
| Compound Name: | N-(1,3-benzothiazol-2-yl)-4-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)butanamide |
| Molecular Weight: | 440.3 |
| Molecular Formula: | C16 H17 I N4 O S |
| Smiles: | Cc1c(c(C)n(CCCC(Nc2nc3ccccc3s2)=O)n1)I |
| Stereo: | ACHIRAL |
| logP: | 2.7303 |
| logD: | 2.7301 |
| logSw: | -3.2033 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.409 |
| InChI Key: | XZEYIYNLRBOPJR-UHFFFAOYSA-N |