2-amino-4-(2H-1,3-benzodioxol-5-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(2H-1,3-benzodioxol-5-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
2-amino-4-(2H-1,3-benzodioxol-5-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | 8005-2691 |
| Compound Name: | 2-amino-4-(2H-1,3-benzodioxol-5-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile |
| Molecular Weight: | 293.32 |
| Molecular Formula: | C17 H15 N3 O2 |
| Smiles: | C1CCc2c(C1)c(c1ccc3c(c1)OCO3)c(C#N)c(N)n2 |
| Stereo: | ACHIRAL |
| logP: | 3.1881 |
| logD: | 3.1853 |
| logSw: | -3.3109 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.872 |
| InChI Key: | XLHNDQCQIVHZLN-UHFFFAOYSA-N |