6-[2-(3-chlorophenyl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
6-[2-(3-chlorophenyl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione
6-[2-(3-chlorophenyl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | 8017-2492 |
| Compound Name: | 6-[2-(3-chlorophenyl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 293.66 |
| Molecular Formula: | C12 H8 Cl N3 O4 |
| Smiles: | C(=C/c1cccc(c1)[Cl])\C1=C(C(NC(N1)=O)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.4193 |
| logD: | -0.6955 |
| logSw: | -3.512 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.408 |
| InChI Key: | NJFTZSDGBXWXJT-UHFFFAOYSA-N |