6-[2-(2-methyl-1H-indol-3-yl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
6-[2-(2-methyl-1H-indol-3-yl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione
6-[2-(2-methyl-1H-indol-3-yl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | 8018-1227 |
| Compound Name: | 6-[2-(2-methyl-1H-indol-3-yl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 312.28 |
| Molecular Formula: | C15 H12 N4 O4 |
| Smiles: | Cc1c(/C=C/C2=C(C(NC(N2)=O)=O)[N+]([O-])=O)c2ccccc2[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 2.0094 |
| logD: | -1.1053 |
| logSw: | -2.5877 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 92.334 |
| InChI Key: | QLMOMCRZNLCDDS-UHFFFAOYSA-N |