methyl 4-[2-(2,4-dichlorophenoxy)propanoyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate
Chemical Structure Depiction of
methyl 4-[2-(2,4-dichlorophenoxy)propanoyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate
methyl 4-[2-(2,4-dichlorophenoxy)propanoyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate
Compound characteristics
Compound ID: | D075-0235 |
Compound Name: | methyl 4-[2-(2,4-dichlorophenoxy)propanoyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate |
Molecular Weight: | 410.25 |
Molecular Formula: | C19 H17 Cl2 N O5 |
Smiles: | CC(C(N1CC(C(=O)OC)Oc2ccccc12)=O)Oc1ccc(cc1[Cl])[Cl] |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 4.3091 |
logD: | 4.3091 |
logSw: | -4.4034 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 50.601 |
InChI Key: | UQLJBNSWTYGTNO-UHFFFAOYSA-N |