2-hydroxy-4-({[1-(4-methylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}amino)benzoic acid
Chemical Structure Depiction of
2-hydroxy-4-({[1-(4-methylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}amino)benzoic acid
2-hydroxy-4-({[1-(4-methylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}amino)benzoic acid
Compound characteristics
| Compound ID: | Y508-1578 |
| Compound Name: | 2-hydroxy-4-({[1-(4-methylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}amino)benzoic acid |
| Molecular Weight: | 381.34 |
| Molecular Formula: | C19 H15 N3 O6 |
| Smiles: | Cc1ccc(cc1)N1C(C(=C/Nc2ccc(C(O)=O)c(c2)O)\C(NC1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.311 |
| logD: | -0.7179 |
| logSw: | -2.8203 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 109.948 |
| InChI Key: | MSMMIXYCQPRRRG-UHFFFAOYSA-N |