N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(3-benzyl-2-oxo-1,3-diazinan-1-yl)benzamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(3-benzyl-2-oxo-1,3-diazinan-1-yl)benzamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(3-benzyl-2-oxo-1,3-diazinan-1-yl)benzamide
Compound characteristics
| Compound ID: | J076-0694 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(3-benzyl-2-oxo-1,3-diazinan-1-yl)benzamide |
| Molecular Weight: | 443.5 |
| Molecular Formula: | C26 H25 N3 O4 |
| Smiles: | C1CN(Cc2ccccc2)C(N(C1)c1ccc(cc1)C(NCc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.827 |
| logD: | 3.827 |
| logSw: | -4.1069 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.326 |
| InChI Key: | AUNLSKKMUDSNBT-UHFFFAOYSA-N |