N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-{3-[(2-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-[(2-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-{3-[(2-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzamide
Compound characteristics
| Compound ID: | J076-0113 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-{3-[(2-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzamide |
| Molecular Weight: | 457.53 |
| Molecular Formula: | C27 H27 N3 O4 |
| Smiles: | Cc1ccccc1CN1CCCN(C1=O)c1ccc(cc1)C(Nc1ccc2c(c1)OCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1251 |
| logD: | 4.1229 |
| logSw: | -4.1833 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.711 |
| InChI Key: | DQRLPNYHDWVECX-UHFFFAOYSA-N |