2-{4-[2-(tert-butylamino)-2-oxoethyl]piperazin-1-yl}-5-[(ethanesulfonyl)amino]benzoic acid
Chemical Structure Depiction of
2-{4-[2-(tert-butylamino)-2-oxoethyl]piperazin-1-yl}-5-[(ethanesulfonyl)amino]benzoic acid
2-{4-[2-(tert-butylamino)-2-oxoethyl]piperazin-1-yl}-5-[(ethanesulfonyl)amino]benzoic acid
Compound characteristics
| Compound ID: | F290-0703 |
| Compound Name: | 2-{4-[2-(tert-butylamino)-2-oxoethyl]piperazin-1-yl}-5-[(ethanesulfonyl)amino]benzoic acid |
| Molecular Weight: | 426.53 |
| Molecular Formula: | C19 H30 N4 O5 S |
| Smiles: | CCS(Nc1ccc(c(c1)C(O)=O)N1CCN(CC1)CC(NC(C)(C)C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4604 |
| logD: | 0.3448 |
| logSw: | -2.9294 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 101.454 |
| InChI Key: | GVFONKAXYFLQSW-UHFFFAOYSA-N |