N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(4-iodo-1H-pyrazol-1-yl)acetamide
Chemical Structure Depiction of
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(4-iodo-1H-pyrazol-1-yl)acetamide
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(4-iodo-1H-pyrazol-1-yl)acetamide
Compound characteristics
| Compound ID: | 8016-9402 |
| Compound Name: | N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(4-iodo-1H-pyrazol-1-yl)acetamide |
| Molecular Weight: | 412.25 |
| Molecular Formula: | C14 H13 I N4 O S |
| Smiles: | C1CCc2c(C1)c(C#N)c(NC(Cn1cc(cn1)I)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.2085 |
| logD: | 2.0402 |
| logSw: | -3.4111 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.665 |
| InChI Key: | OXEONHPOKVOFPD-UHFFFAOYSA-N |