2-[4-(dimethylamino)phenyl]-9-ethoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Chemical Structure Depiction of
2-[4-(dimethylamino)phenyl]-9-ethoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
2-[4-(dimethylamino)phenyl]-9-ethoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Compound characteristics
| Compound ID: | C766-0155 |
| Compound Name: | 2-[4-(dimethylamino)phenyl]-9-ethoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione |
| Molecular Weight: | 379.48 |
| Molecular Formula: | C21 H21 N3 O2 S |
| Smiles: | CCOc1cccc2CC3=C(N=C(c4ccc(cc4)N(C)C)NC3=S)Oc12 |
| Stereo: | ACHIRAL |
| logP: | 4.4616 |
| logD: | 4.4616 |
| logSw: | -4.3442 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.334 |
| InChI Key: | NNLMNJJQFQZNKL-UHFFFAOYSA-N |