9-ethoxy-2-(pyridin-3-yl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Chemical Structure Depiction of
9-ethoxy-2-(pyridin-3-yl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
9-ethoxy-2-(pyridin-3-yl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Compound characteristics
| Compound ID: | C766-0599 |
| Compound Name: | 9-ethoxy-2-(pyridin-3-yl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione |
| Molecular Weight: | 337.4 |
| Molecular Formula: | C18 H15 N3 O2 S |
| Smiles: | CCOc1cccc2CC3=C(N=C(c4cccnc4)NC3=S)Oc12 |
| Stereo: | ACHIRAL |
| logP: | 2.9889 |
| logD: | 2.9889 |
| logSw: | -3.0351 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.047 |
| InChI Key: | CIYUJNFORNLWGC-UHFFFAOYSA-N |