N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2-methyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl)benzamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2-methyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl)benzamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2-methyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl)benzamide
Compound characteristics
| Compound ID: | C326-0025 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2-methyl-4-oxo-5,6-dihydro-2H-2,6-methano-1,3,5-benzoxadiazocin-3(4H)-yl)benzamide |
| Molecular Weight: | 457.49 |
| Molecular Formula: | C26 H23 N3 O5 |
| Smiles: | CC12CC(c3ccccc3O2)NC(N1c1cccc(c1)C(Nc1ccc2c(c1)OCCO2)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.2992 |
| logD: | 3.2989 |
| logSw: | -3.7548 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.991 |
| InChI Key: | JDWCUHPQEPDZQD-UHFFFAOYSA-N |