5-(4-{2-[(2-methylpropyl)amino]-2-oxoethyl}piperazin-1-yl)-2-(2-phenoxyacetamido)benzoic acid
Chemical Structure Depiction of
5-(4-{2-[(2-methylpropyl)amino]-2-oxoethyl}piperazin-1-yl)-2-(2-phenoxyacetamido)benzoic acid
5-(4-{2-[(2-methylpropyl)amino]-2-oxoethyl}piperazin-1-yl)-2-(2-phenoxyacetamido)benzoic acid
Compound characteristics
| Compound ID: | F687-1030 |
| Compound Name: | 5-(4-{2-[(2-methylpropyl)amino]-2-oxoethyl}piperazin-1-yl)-2-(2-phenoxyacetamido)benzoic acid |
| Molecular Weight: | 468.55 |
| Molecular Formula: | C25 H32 N4 O5 |
| Smiles: | CC(C)CNC(CN1CCN(CC1)c1ccc(c(c1)C(O)=O)NC(COc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7869 |
| logD: | -0.9162 |
| logSw: | -3.3263 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.062 |
| InChI Key: | OCUNQUWPMPCGHQ-UHFFFAOYSA-N |