5-[(3,4-dimethylbenzene-1-sulfonyl)amino]-2-{4-[2-oxo-2-(propylamino)ethyl]piperazin-1-yl}benzoic acid
Chemical Structure Depiction of
5-[(3,4-dimethylbenzene-1-sulfonyl)amino]-2-{4-[2-oxo-2-(propylamino)ethyl]piperazin-1-yl}benzoic acid
5-[(3,4-dimethylbenzene-1-sulfonyl)amino]-2-{4-[2-oxo-2-(propylamino)ethyl]piperazin-1-yl}benzoic acid
Compound characteristics
| Compound ID: | F290-0656 |
| Compound Name: | 5-[(3,4-dimethylbenzene-1-sulfonyl)amino]-2-{4-[2-oxo-2-(propylamino)ethyl]piperazin-1-yl}benzoic acid |
| Molecular Weight: | 488.61 |
| Molecular Formula: | C24 H32 N4 O5 S |
| Smiles: | CCCNC(CN1CCN(CC1)c1ccc(cc1C(O)=O)NS(c1ccc(C)c(C)c1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7175 |
| logD: | 1.6019 |
| logSw: | -3.816 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 100.573 |
| InChI Key: | PGQNROSBFRMRET-UHFFFAOYSA-N |