7-bromo-2-(4-hydroxyphenyl)-9-methoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
7-bromo-2-(4-hydroxyphenyl)-9-methoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one
7-bromo-2-(4-hydroxyphenyl)-9-methoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | E139-0352 |
| Compound Name: | 7-bromo-2-(4-hydroxyphenyl)-9-methoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 401.21 |
| Molecular Formula: | C18 H13 Br N2 O4 |
| Smiles: | COc1cc(cc2CC3=C(N=C(c4ccc(cc4)O)NC3=O)Oc12)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.2264 |
| logD: | 3.1388 |
| logSw: | -3.6251 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.648 |
| InChI Key: | ZROFREZQQSZACV-UHFFFAOYSA-N |