7-chloro-2-(2,3,4-trimethoxyphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
7-chloro-2-(2,3,4-trimethoxyphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one
7-chloro-2-(2,3,4-trimethoxyphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | E139-0048 |
| Compound Name: | 7-chloro-2-(2,3,4-trimethoxyphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 400.82 |
| Molecular Formula: | C20 H17 Cl N2 O5 |
| Smiles: | COc1ccc(C2NC(C3Cc4cc(ccc4OC=3N=2)[Cl])=O)c(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 3.4239 |
| logD: | 3.1173 |
| logSw: | -3.91 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.781 |
| InChI Key: | FIQVWLCIUZKGKC-UHFFFAOYSA-N |