2-amino-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile
Chemical Structure Depiction of
2-amino-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile
2-amino-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile
Compound characteristics
| Compound ID: | R052-0786 |
| Compound Name: | 2-amino-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile |
| Molecular Weight: | 192.28 |
| Molecular Formula: | C10 H12 N2 S |
| Smiles: | C1CCc2c(C#N)c(N)sc2CC1 |
| Stereo: | ACHIRAL |
| logP: | 2.6422 |
| logD: | 2.6422 |
| logSw: | -2.7776 |
| Hydrogen bond acceptors count: | 1 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 38.822 |
| InChI Key: | GBQACFCEZPKMTA-UHFFFAOYSA-N |