5-(4-chlorobenzamido)-2-{[(1,4-dioxan-2-yl)methyl](methyl)amino}benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-(4-chlorobenzamido)-2-{[(1,4-dioxan-2-yl)methyl](methyl)amino}benzoic acid--trifluoroacetic acid (1/1)
5-(4-chlorobenzamido)-2-{[(1,4-dioxan-2-yl)methyl](methyl)amino}benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | G889-1131 |
| Compound Name: | 5-(4-chlorobenzamido)-2-{[(1,4-dioxan-2-yl)methyl](methyl)amino}benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 518.87 |
| Molecular Formula: | C20 H21 Cl N2 O5 |
| Salt: | CF3COOH |
| Smiles: | CN(CC1COCCO1)c1ccc(cc1C(O)=O)NC(c1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7076 |
| logD: | 0.4569 |
| logSw: | -3.5681 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.086 |
| InChI Key: | GOMJQNOWALAHII-INIZCTEOSA-N |