5-{4-[2-(tert-butylamino)-2-oxoethyl]piperazin-1-yl}-2-[2-(4-methylphenyl)acetamido]benzoic acid
Chemical Structure Depiction of
5-{4-[2-(tert-butylamino)-2-oxoethyl]piperazin-1-yl}-2-[2-(4-methylphenyl)acetamido]benzoic acid
5-{4-[2-(tert-butylamino)-2-oxoethyl]piperazin-1-yl}-2-[2-(4-methylphenyl)acetamido]benzoic acid
Compound characteristics
| Compound ID: | F687-1219 |
| Compound Name: | 5-{4-[2-(tert-butylamino)-2-oxoethyl]piperazin-1-yl}-2-[2-(4-methylphenyl)acetamido]benzoic acid |
| Molecular Weight: | 466.58 |
| Molecular Formula: | C26 H34 N4 O4 |
| Smiles: | Cc1ccc(CC(Nc2ccc(cc2C(O)=O)N2CCN(CC2)CC(NC(C)(C)C)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.4359 |
| logD: | -0.2672 |
| logSw: | -3.4532 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 81.386 |
| InChI Key: | FUYPXPZUBYHNQD-UHFFFAOYSA-N |