methyl 4-[(3,4-dimethylphenoxy)acetyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate
Chemical Structure Depiction of
methyl 4-[(3,4-dimethylphenoxy)acetyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate
methyl 4-[(3,4-dimethylphenoxy)acetyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate
Compound characteristics
| Compound ID: | D075-0217 |
| Compound Name: | methyl 4-[(3,4-dimethylphenoxy)acetyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate |
| Molecular Weight: | 355.39 |
| Molecular Formula: | C20 H21 N O5 |
| Smiles: | Cc1ccc(cc1C)OCC(N1CC(C(=O)OC)Oc2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5552 |
| logD: | 3.5552 |
| logSw: | -3.7295 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.697 |
| InChI Key: | ODTJGQADJAKDIL-SFHVURJKSA-N |