3-(3-chlorobenzamido)-4-(4-{2-[(3-methoxypropyl)amino]-2-oxoethyl}piperazin-1-yl)benzoic acid
Chemical Structure Depiction of
3-(3-chlorobenzamido)-4-(4-{2-[(3-methoxypropyl)amino]-2-oxoethyl}piperazin-1-yl)benzoic acid
3-(3-chlorobenzamido)-4-(4-{2-[(3-methoxypropyl)amino]-2-oxoethyl}piperazin-1-yl)benzoic acid
Compound characteristics
| Compound ID: | F086-0661 |
| Compound Name: | 3-(3-chlorobenzamido)-4-(4-{2-[(3-methoxypropyl)amino]-2-oxoethyl}piperazin-1-yl)benzoic acid |
| Molecular Weight: | 488.97 |
| Molecular Formula: | C24 H29 Cl N4 O5 |
| Smiles: | COCCCNC(CN1CCN(CC1)c1ccc(cc1NC(c1cccc(c1)[Cl])=O)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3718 |
| logD: | 1.4774 |
| logSw: | -3.6657 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.659 |
| InChI Key: | LBMWNSYREIBTBU-UHFFFAOYSA-N |