1,3-dimethyl-5-[(2-nitrophenyl)methyl]-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
1,3-dimethyl-5-[(2-nitrophenyl)methyl]-1,3-diazinane-2,4,6-trione
1,3-dimethyl-5-[(2-nitrophenyl)methyl]-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 1014-0041 |
| Compound Name: | 1,3-dimethyl-5-[(2-nitrophenyl)methyl]-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 291.26 |
| Molecular Formula: | C13 H13 N3 O5 |
| Smiles: | CN1C(C(Cc2ccccc2[N+]([O-])=O)C(N(C)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0003 |
| logD: | -3.46 |
| logSw: | -1.8063 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 78.206 |
| InChI Key: | CWDYJJJWBMZUNU-UHFFFAOYSA-N |