5-{[4-(dimethylamino)-3-nitrophenyl]methylidene}-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-{[4-(dimethylamino)-3-nitrophenyl]methylidene}-1,3-diazinane-2,4,6-trione
5-{[4-(dimethylamino)-3-nitrophenyl]methylidene}-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 8002-3461 |
| Compound Name: | 5-{[4-(dimethylamino)-3-nitrophenyl]methylidene}-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 304.26 |
| Molecular Formula: | C13 H12 N4 O5 |
| Smiles: | CN(C)c1ccc(C=C2C(NC(NC2=O)=O)=O)cc1[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.8569 |
| logD: | 0.5096 |
| logSw: | -2.3053 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 98.228 |
| InChI Key: | INCCZBKYRPVEAS-UHFFFAOYSA-N |