4-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-6-fluoroquinoline-3-carbonitrile--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-6-fluoroquinoline-3-carbonitrile--hydrogen chloride (1/1)
4-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-6-fluoroquinoline-3-carbonitrile--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | F360-0310 |
| Compound Name: | 4-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-6-fluoroquinoline-3-carbonitrile--hydrogen chloride (1/1) |
| Molecular Weight: | 357.77 |
| Molecular Formula: | C18 H12 F N3 O2 |
| Salt: | HCl |
| Smiles: | C1COc2cc(ccc2O1)Nc1c(C#N)cnc2ccc(cc12)F |
| Stereo: | ACHIRAL |
| logP: | 2.5045 |
| logD: | 2.5045 |
| logSw: | -3.0095 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.487 |
| InChI Key: | XDMMCIZQLYYVQH-UHFFFAOYSA-N |