4-{[2,3-dioxo-4-(propan-2-yl)piperazin-1-yl]methyl}benzoic acid
Chemical Structure Depiction of
4-{[2,3-dioxo-4-(propan-2-yl)piperazin-1-yl]methyl}benzoic acid
4-{[2,3-dioxo-4-(propan-2-yl)piperazin-1-yl]methyl}benzoic acid
Compound characteristics
| Compound ID: | FF01-2297 |
| Compound Name: | 4-{[2,3-dioxo-4-(propan-2-yl)piperazin-1-yl]methyl}benzoic acid |
| Molecular Weight: | 290.32 |
| Molecular Formula: | C15 H18 N2 O4 |
| Smiles: | CC(C)N1CCN(Cc2ccc(cc2)C(O)=O)C(C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4043 |
| logD: | -1.5672 |
| logSw: | -1.8393 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.849 |
| InChI Key: | VVHGKFVEVAOVBP-UHFFFAOYSA-N |