5-{[1-(4-chloro-3-nitrophenyl)-1H-pyrrol-2-yl]methylidene}-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-{[1-(4-chloro-3-nitrophenyl)-1H-pyrrol-2-yl]methylidene}-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione
5-{[1-(4-chloro-3-nitrophenyl)-1H-pyrrol-2-yl]methylidene}-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | C370-1465 |
| Compound Name: | 5-{[1-(4-chloro-3-nitrophenyl)-1H-pyrrol-2-yl]methylidene}-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 471.25 |
| Molecular Formula: | C21 H12 Cl2 N4 O5 |
| Smiles: | C(=C1/C(NC(N(C1=O)c1ccc(cc1)[Cl])=O)=O)\c1cccn1c1ccc(c(c1)[N+]([O-])=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.0456 |
| logD: | 3.7866 |
| logSw: | -4.5376 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89 |
| InChI Key: | RUTOYAQXEVAJGL-UHFFFAOYSA-N |