4-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-2-methyl-1,4-benzoxazepine-3,5(2H,4H)-dione
Chemical Structure Depiction of
4-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-2-methyl-1,4-benzoxazepine-3,5(2H,4H)-dione
4-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-2-methyl-1,4-benzoxazepine-3,5(2H,4H)-dione
Compound characteristics
| Compound ID: | D391-0096 |
| Compound Name: | 4-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-2-methyl-1,4-benzoxazepine-3,5(2H,4H)-dione |
| Molecular Weight: | 369.37 |
| Molecular Formula: | C20 H19 N O6 |
| Smiles: | [H]C([H])(C(c1ccc(c(c1)OC)OC)=O)N1C(C(C)Oc2ccccc2C1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8568 |
| logD: | 1.8568 |
| logSw: | -2.6781 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.695 |
| InChI Key: | XCBPRNXQKVKABJ-GFCCVEGCSA-N |