methyl N-(4-{3-[(4-chlorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzoyl)glycinate
Chemical Structure Depiction of
methyl N-(4-{3-[(4-chlorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzoyl)glycinate
methyl N-(4-{3-[(4-chlorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzoyl)glycinate
Compound characteristics
| Compound ID: | J076-0515 |
| Compound Name: | methyl N-(4-{3-[(4-chlorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzoyl)glycinate |
| Molecular Weight: | 415.88 |
| Molecular Formula: | C21 H22 Cl N3 O4 |
| Smiles: | COC(CNC(c1ccc(cc1)N1CCCN(Cc2ccc(cc2)[Cl])C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8061 |
| logD: | 2.806 |
| logSw: | -3.6421 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.061 |
| InChI Key: | IHAOOWJPQCAWCV-UHFFFAOYSA-N |