methyl 4-[2-(4-ethylphenoxy)propanoyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate
Chemical Structure Depiction of
methyl 4-[2-(4-ethylphenoxy)propanoyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate
methyl 4-[2-(4-ethylphenoxy)propanoyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate
Compound characteristics
| Compound ID: | D075-0232 |
| Compound Name: | methyl 4-[2-(4-ethylphenoxy)propanoyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate |
| Molecular Weight: | 369.42 |
| Molecular Formula: | C21 H23 N O5 |
| Smiles: | CCc1ccc(cc1)OC(C)C(N1CC(C(=O)OC)Oc2ccccc12)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.8904 |
| logD: | 3.8904 |
| logSw: | -3.9955 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.515 |
| InChI Key: | PGYYGCATJCGIDU-UHFFFAOYSA-N |