N-(4-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-2-phenoxyacetamide
Chemical Structure Depiction of
N-(4-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-2-phenoxyacetamide
N-(4-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-2-phenoxyacetamide
Compound characteristics
| Compound ID: | V028-8456 |
| Compound Name: | N-(4-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)-2-phenoxyacetamide |
| Molecular Weight: | 459.5 |
| Molecular Formula: | C26 H25 N3 O5 |
| Smiles: | C1CN(Cc2ccc3c(c2)OCO3)C(N(C1)c1ccc(cc1)NC(COc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1249 |
| logD: | 4.1249 |
| logSw: | -4.1954 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.289 |
| InChI Key: | BZFHNNJKKHMVSD-UHFFFAOYSA-N |