methyl 4-[(4-chlorophenoxy)acetyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate
Chemical Structure Depiction of
methyl 4-[(4-chlorophenoxy)acetyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate
methyl 4-[(4-chlorophenoxy)acetyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate
Compound characteristics
| Compound ID: | D075-0162 |
| Compound Name: | methyl 4-[(4-chlorophenoxy)acetyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate |
| Molecular Weight: | 361.78 |
| Molecular Formula: | C18 H16 Cl N O5 |
| Smiles: | COC(C1CN(C(COc2ccc(cc2)[Cl])=O)c2ccccc2O1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1135 |
| logD: | 3.1135 |
| logSw: | -3.3915 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.697 |
| InChI Key: | KHNQMEYYRKRLHN-MRXNPFEDSA-N |