N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-4-iodo-1-methyl-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-4-iodo-1-methyl-1H-pyrazole-3-carboxamide
N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-4-iodo-1-methyl-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y500-4981 |
| Compound Name: | N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-4-iodo-1-methyl-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 398.22 |
| Molecular Formula: | C13 H11 I N4 O S |
| Smiles: | Cn1cc(c(C(Nc2c(C#N)c3CCCc3s2)=O)n1)I |
| Stereo: | ACHIRAL |
| logP: | 2.5404 |
| logD: | -0.215 |
| logSw: | -2.7854 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.822 |
| InChI Key: | UPWHXHUGJLLHJM-UHFFFAOYSA-N |