methyl N-[4-(3-benzyl-2-oxo-1,3-diazinan-1-yl)benzoyl]glycinate
Chemical Structure Depiction of
methyl N-[4-(3-benzyl-2-oxo-1,3-diazinan-1-yl)benzoyl]glycinate
methyl N-[4-(3-benzyl-2-oxo-1,3-diazinan-1-yl)benzoyl]glycinate
Compound characteristics
| Compound ID: | J076-0682 |
| Compound Name: | methyl N-[4-(3-benzyl-2-oxo-1,3-diazinan-1-yl)benzoyl]glycinate |
| Molecular Weight: | 381.43 |
| Molecular Formula: | C21 H23 N3 O4 |
| Smiles: | COC(CNC(c1ccc(cc1)N1CCCN(Cc2ccccc2)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2113 |
| logD: | 2.2113 |
| logSw: | -2.6465 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.061 |
| InChI Key: | HCCUSXAMJHEBPH-UHFFFAOYSA-N |