2-(4-chlorophenyl)-9-methoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
2-(4-chlorophenyl)-9-methoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one
2-(4-chlorophenyl)-9-methoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | E139-0104 |
| Compound Name: | 2-(4-chlorophenyl)-9-methoxy-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 340.76 |
| Molecular Formula: | C18 H13 Cl N2 O3 |
| Smiles: | COc1cccc2CC3=C(N=C(c4ccc(cc4)[Cl])NC3=O)Oc12 |
| Stereo: | ACHIRAL |
| logP: | 3.6406 |
| logD: | 2.9592 |
| logSw: | -4.3563 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.032 |
| InChI Key: | RGXXQKRKOIZVCR-UHFFFAOYSA-N |