1-ethyl-N-[(4-iodo-2-methylphenyl)carbamothioyl]-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
1-ethyl-N-[(4-iodo-2-methylphenyl)carbamothioyl]-1H-pyrazole-4-carboxamide
1-ethyl-N-[(4-iodo-2-methylphenyl)carbamothioyl]-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | Y500-9720 |
| Compound Name: | 1-ethyl-N-[(4-iodo-2-methylphenyl)carbamothioyl]-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 414.27 |
| Molecular Formula: | C14 H15 I N4 O S |
| Smiles: | CCn1cc(cn1)C(NC(Nc1ccc(cc1C)I)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6999 |
| logD: | 3.699 |
| logSw: | -3.7535 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.044 |
| InChI Key: | DOFCROGHYRDLKE-UHFFFAOYSA-N |