4-[2-(4-methoxyphenyl)-2-oxoethyl]-1,4-benzoxazepine-3,5(2H,4H)-dione
Chemical Structure Depiction of
4-[2-(4-methoxyphenyl)-2-oxoethyl]-1,4-benzoxazepine-3,5(2H,4H)-dione
4-[2-(4-methoxyphenyl)-2-oxoethyl]-1,4-benzoxazepine-3,5(2H,4H)-dione
Compound characteristics
| Compound ID: | D391-0005 |
| Compound Name: | 4-[2-(4-methoxyphenyl)-2-oxoethyl]-1,4-benzoxazepine-3,5(2H,4H)-dione |
| Molecular Weight: | 325.32 |
| Molecular Formula: | C18 H15 N O5 |
| Smiles: | [H]C([H])(C(c1ccc(cc1)OC)=O)N1C(COc2ccccc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4726 |
| logD: | 1.4726 |
| logSw: | -2.2756 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.974 |
| InChI Key: | QRSHMEIXFUUPPM-UHFFFAOYSA-N |