5-chloro-N-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-2-nitrobenzamide
Chemical Structure Depiction of
5-chloro-N-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-2-nitrobenzamide
5-chloro-N-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-2-nitrobenzamide
Compound characteristics
Compound ID: | G856-3638 |
Compound Name: | 5-chloro-N-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-2-nitrobenzamide |
Molecular Weight: | 338.7 |
Molecular Formula: | C13 H11 Cl N4 O5 |
Smiles: | CN1C(=CC(N(C)C1=O)=O)NC(c1cc(ccc1[N+]([O-])=O)[Cl])=O |
Stereo: | ACHIRAL |
logP: | 1.1795 |
logD: | -1.8233 |
logSw: | -2.9172 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 87.414 |
InChI Key: | FKVMBFFMTANXLA-UHFFFAOYSA-N |