5-(4-{2-[(3-methoxypropyl)amino]-2-oxoethyl}piperazin-1-yl)-2-(4-methylbenzamido)benzoic acid
Chemical Structure Depiction of
5-(4-{2-[(3-methoxypropyl)amino]-2-oxoethyl}piperazin-1-yl)-2-(4-methylbenzamido)benzoic acid
5-(4-{2-[(3-methoxypropyl)amino]-2-oxoethyl}piperazin-1-yl)-2-(4-methylbenzamido)benzoic acid
Compound characteristics
| Compound ID: | F687-0068 |
| Compound Name: | 5-(4-{2-[(3-methoxypropyl)amino]-2-oxoethyl}piperazin-1-yl)-2-(4-methylbenzamido)benzoic acid |
| Molecular Weight: | 468.55 |
| Molecular Formula: | C25 H32 N4 O5 |
| Smiles: | Cc1ccc(cc1)C(Nc1ccc(cc1C(O)=O)N1CCN(CC1)CC(NCCCOC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4461 |
| logD: | -1.6702 |
| logSw: | -2.9302 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.96 |
| InChI Key: | WALWCCXIBADQIG-UHFFFAOYSA-N |