1-methyl-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
1-methyl-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione
1-methyl-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 3448-4436 |
| Compound Name: | 1-methyl-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 281.24 |
| Molecular Formula: | C10 H7 N3 O5 S |
| Smiles: | CN1C(C(=C/c2ccc([N+]([O-])=O)s2)\C(NC1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1668 |
| logD: | 0.9073 |
| logSw: | -2.3367 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.791 |
| InChI Key: | BPWLZLMNMKZPLP-UHFFFAOYSA-N |