2-(4-fluorophenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Chemical Structure Depiction of
2-(4-fluorophenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
2-(4-fluorophenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Compound characteristics
| Compound ID: | C766-0011 |
| Compound Name: | 2-(4-fluorophenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione |
| Molecular Weight: | 310.35 |
| Molecular Formula: | C17 H11 F N2 O S |
| Smiles: | C1C2=C(N=C(c3ccc(cc3)F)NC2=S)Oc2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 4.0503 |
| logD: | 2.7145 |
| logSw: | -4.4859 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.6349 |
| InChI Key: | NIEXHTKMQNEISJ-UHFFFAOYSA-N |