2-{[1-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1H-pyrrol-2-yl]methylidene}hydrazine-1-carbothioamide
Chemical Structure Depiction of
2-{[1-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1H-pyrrol-2-yl]methylidene}hydrazine-1-carbothioamide
2-{[1-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1H-pyrrol-2-yl]methylidene}hydrazine-1-carbothioamide
Compound characteristics
| Compound ID: | 8008-4441 |
| Compound Name: | 2-{[1-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1H-pyrrol-2-yl]methylidene}hydrazine-1-carbothioamide |
| Molecular Weight: | 329.44 |
| Molecular Formula: | C15 H15 N5 S2 |
| Smiles: | C1CCc2c(C1)c(C#N)c(n1cccc1/C=N/NC(N)=S)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.7833 |
| logD: | 3.7833 |
| logSw: | -4.4609 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 62.622 |
| InChI Key: | OUFZEWRFDKATDT-UHFFFAOYSA-N |