7-chloro-2-phenyl-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Chemical Structure Depiction of
7-chloro-2-phenyl-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
7-chloro-2-phenyl-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Compound characteristics
| Compound ID: | C766-0036 |
| Compound Name: | 7-chloro-2-phenyl-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione |
| Molecular Weight: | 326.8 |
| Molecular Formula: | C17 H11 Cl N2 O S |
| Smiles: | C1C2=C(N=C(c3ccccc3)NC2=S)Oc2ccc(cc12)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.4545 |
| logD: | 4.4545 |
| logSw: | -4.7767 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.6349 |
| InChI Key: | HDCWDFBHKRBPDK-UHFFFAOYSA-N |