1,3-dimethyl-5-{[1-(4-nitrophenyl)-1H-pyrrol-2-yl]methylidene}-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
1,3-dimethyl-5-{[1-(4-nitrophenyl)-1H-pyrrol-2-yl]methylidene}-1,3-diazinane-2,4,6-trione
1,3-dimethyl-5-{[1-(4-nitrophenyl)-1H-pyrrol-2-yl]methylidene}-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 8009-2559 |
| Compound Name: | 1,3-dimethyl-5-{[1-(4-nitrophenyl)-1H-pyrrol-2-yl]methylidene}-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 354.32 |
| Molecular Formula: | C17 H14 N4 O5 |
| Smiles: | CN1C(C(=Cc2cccn2c2ccc(cc2)[N+]([O-])=O)C(N(C)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4751 |
| logD: | 2.4751 |
| logSw: | -2.4923 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 81.036 |
| InChI Key: | VJOZCPKBPYZTQL-UHFFFAOYSA-N |