6-[2-(5-bromo-2-methoxyphenyl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
6-[2-(5-bromo-2-methoxyphenyl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione
6-[2-(5-bromo-2-methoxyphenyl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | 3615-0340 |
| Compound Name: | 6-[2-(5-bromo-2-methoxyphenyl)ethenyl]-5-nitropyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 368.14 |
| Molecular Formula: | C13 H10 Br N3 O5 |
| Smiles: | COc1ccc(cc1/C=C/C1=C(C(NC(N1)=O)=O)[N+]([O-])=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.5547 |
| logD: | -0.56 |
| logSw: | -3.1238 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.038 |
| InChI Key: | PYWBDADWHHJHAT-UHFFFAOYSA-N |