N-[(1H-benzimidazol-2-yl)methyl]-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(propan-2-yl)-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-[(1H-benzimidazol-2-yl)methyl]-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(propan-2-yl)-1H-pyrazole-3-carboxamide
N-[(1H-benzimidazol-2-yl)methyl]-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(propan-2-yl)-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | D473-2079 |
| Compound Name: | N-[(1H-benzimidazol-2-yl)methyl]-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(propan-2-yl)-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 401.49 |
| Molecular Formula: | C19 H23 N5 O3 S |
| Smiles: | CC(C)c1cc(C(NCc2nc3ccccc3[nH]2)=O)nn1C1CCS(C1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6661 |
| logD: | 1.665 |
| logSw: | -2.5042 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.298 |
| InChI Key: | JGLLYOVXCKEEKV-CYBMUJFWSA-N |