1,3-dibenzyl-2-(6-nitro-2H-1,3-benzodioxol-5-yl)-1,3-diazinane
Chemical Structure Depiction of
1,3-dibenzyl-2-(6-nitro-2H-1,3-benzodioxol-5-yl)-1,3-diazinane
1,3-dibenzyl-2-(6-nitro-2H-1,3-benzodioxol-5-yl)-1,3-diazinane
Compound characteristics
| Compound ID: | 8011-8341 |
| Compound Name: | 1,3-dibenzyl-2-(6-nitro-2H-1,3-benzodioxol-5-yl)-1,3-diazinane |
| Molecular Weight: | 431.49 |
| Molecular Formula: | C25 H25 N3 O4 |
| Smiles: | C1CN(Cc2ccccc2)C(c2cc3c(cc2[N+]([O-])=O)OCO3)N(C1)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.6549 |
| logD: | 4.2674 |
| logSw: | -4.7039 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.909 |
| InChI Key: | FZTVVKPNQZSUBU-UHFFFAOYSA-N |