5-{4-[2-(butylamino)-2-oxoethyl]piperazin-1-yl}-2-(4-methoxybenzamido)benzoic acid
Chemical Structure Depiction of
5-{4-[2-(butylamino)-2-oxoethyl]piperazin-1-yl}-2-(4-methoxybenzamido)benzoic acid
5-{4-[2-(butylamino)-2-oxoethyl]piperazin-1-yl}-2-(4-methoxybenzamido)benzoic acid
Compound characteristics
| Compound ID: | F687-0940 |
| Compound Name: | 5-{4-[2-(butylamino)-2-oxoethyl]piperazin-1-yl}-2-(4-methoxybenzamido)benzoic acid |
| Molecular Weight: | 468.55 |
| Molecular Formula: | C25 H32 N4 O5 |
| Smiles: | CCCCNC(CN1CCN(CC1)c1ccc(c(c1)C(O)=O)NC(c1ccc(cc1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1252 |
| logD: | -0.991 |
| logSw: | -3.307 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.161 |
| InChI Key: | NDUBQSYHTYVOFH-UHFFFAOYSA-N |