N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-{3-[(3-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-{3-[(3-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-{3-[(3-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzamide
Compound characteristics
| Compound ID: | J076-0292 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-{3-[(3-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzamide |
| Molecular Weight: | 457.53 |
| Molecular Formula: | C27 H27 N3 O4 |
| Smiles: | Cc1cccc(CN2CCCN(C2=O)c2ccc(cc2)C(Nc2ccc3c(c2)OCCO3)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.8672 |
| logD: | 3.865 |
| logSw: | -3.9343 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.711 |
| InChI Key: | PMQPOSVVVOZEBP-UHFFFAOYSA-N |