7-bromo-2-(5-chloro-2-hydroxyphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
7-bromo-2-(5-chloro-2-hydroxyphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one
7-bromo-2-(5-chloro-2-hydroxyphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | C201-0023 |
| Compound Name: | 7-bromo-2-(5-chloro-2-hydroxyphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 405.63 |
| Molecular Formula: | C17 H10 Br Cl N2 O3 |
| Smiles: | C1C2=C(N=C(c3cc(ccc3O)[Cl])NC2=O)Oc2ccc(cc12)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.6204 |
| logD: | 3.3149 |
| logSw: | -4.4107 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.265 |
| InChI Key: | WRIIOJKKLXZKSQ-UHFFFAOYSA-N |