N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-4-iodo-1-methyl-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-4-iodo-1-methyl-1H-pyrazole-3-carboxamide
N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-4-iodo-1-methyl-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y500-5060 |
| Compound Name: | N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-4-iodo-1-methyl-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 400.24 |
| Molecular Formula: | C13 H13 I N4 O S |
| Smiles: | CCc1c(C#N)c(NC(c2c(cn(C)n2)I)=O)sc1C |
| Stereo: | ACHIRAL |
| logP: | 2.9811 |
| logD: | 0.2257 |
| logSw: | -3.2568 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.536 |
| InChI Key: | ZXBIPRXYACAFJM-UHFFFAOYSA-N |