methyl 4-[(4-chloro-3,5-dimethylphenoxy)acetyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate
Chemical Structure Depiction of
methyl 4-[(4-chloro-3,5-dimethylphenoxy)acetyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate
methyl 4-[(4-chloro-3,5-dimethylphenoxy)acetyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate
Compound characteristics
| Compound ID: | D075-0214 |
| Compound Name: | methyl 4-[(4-chloro-3,5-dimethylphenoxy)acetyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate |
| Molecular Weight: | 389.83 |
| Molecular Formula: | C20 H20 Cl N O5 |
| Smiles: | Cc1cc(cc(C)c1[Cl])OCC(N1CC(C(=O)OC)Oc2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1497 |
| logD: | 4.1497 |
| logSw: | -4.595 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.697 |
| InChI Key: | ZJECGUAIFNIYTM-QGZVFWFLSA-N |