5-[(4-methylbenzene-1-sulfonyl)amino]-2-{4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]piperazin-1-yl}benzoic acid
Chemical Structure Depiction of
5-[(4-methylbenzene-1-sulfonyl)amino]-2-{4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]piperazin-1-yl}benzoic acid
5-[(4-methylbenzene-1-sulfonyl)amino]-2-{4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]piperazin-1-yl}benzoic acid
Compound characteristics
| Compound ID: | F290-0670 |
| Compound Name: | 5-[(4-methylbenzene-1-sulfonyl)amino]-2-{4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]piperazin-1-yl}benzoic acid |
| Molecular Weight: | 486.59 |
| Molecular Formula: | C24 H30 N4 O5 S |
| Smiles: | Cc1ccc(cc1)S(Nc1ccc(c(c1)C(O)=O)N1CCN(CC1)CC(N1CCCC1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8398 |
| logD: | 0.7242 |
| logSw: | -3.4868 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.747 |
| InChI Key: | UXAXTODIOFQHOT-UHFFFAOYSA-N |