2-hydroxy-5-{5-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]furan-2-yl}benzoic acid
Chemical Structure Depiction of
2-hydroxy-5-{5-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]furan-2-yl}benzoic acid
2-hydroxy-5-{5-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]furan-2-yl}benzoic acid
Compound characteristics
| Compound ID: | 8002-3999 |
| Compound Name: | 2-hydroxy-5-{5-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]furan-2-yl}benzoic acid |
| Molecular Weight: | 342.26 |
| Molecular Formula: | C16 H10 N2 O7 |
| Smiles: | C(=C1C(NC(NC1=O)=O)=O)c1ccc(c2ccc(c(c2)C(O)=O)O)o1 |
| Stereo: | ACHIRAL |
| logP: | 2.2773 |
| logD: | -1.8703 |
| logSw: | -2.8307 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 115.169 |
| InChI Key: | SXSQINUKGBEVEJ-UHFFFAOYSA-N |