1,3-dihydroxy-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Chemical Structure Depiction of
1,3-dihydroxy-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
1,3-dihydroxy-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Compound characteristics
| Compound ID: | 8015-8619 |
| Compound Name: | 1,3-dihydroxy-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile |
| Molecular Weight: | 190.2 |
| Molecular Formula: | C10 H10 N2 O2 |
| Smiles: | C1CCc2c(C1)c(C#N)c(nc2O)O |
| Stereo: | ACHIRAL |
| logP: | 1.171 |
| logD: | -0.7398 |
| logSw: | -1.0626 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.752 |
| InChI Key: | WKMMNYRXRAOVAE-UHFFFAOYSA-N |