9-methyl-2-(3,4,5-trimethoxyphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
9-methyl-2-(3,4,5-trimethoxyphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one
9-methyl-2-(3,4,5-trimethoxyphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | E139-0212 |
| Compound Name: | 9-methyl-2-(3,4,5-trimethoxyphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 380.4 |
| Molecular Formula: | C21 H20 N2 O5 |
| Smiles: | Cc1cccc2CC3=C(N=C(c4cc(c(c(c4)OC)OC)OC)NC3=O)Oc12 |
| Stereo: | ACHIRAL |
| logP: | 3.2546 |
| logD: | 3.2376 |
| logSw: | -3.4936 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.379 |
| InChI Key: | JUHJCGPIZJSDSI-UHFFFAOYSA-N |