5-[(methanesulfonyl)amino]-2-(4-{2-[(3-methoxypropyl)amino]-2-oxoethyl}piperazin-1-yl)benzoic acid
Chemical Structure Depiction of
5-[(methanesulfonyl)amino]-2-(4-{2-[(3-methoxypropyl)amino]-2-oxoethyl}piperazin-1-yl)benzoic acid
5-[(methanesulfonyl)amino]-2-(4-{2-[(3-methoxypropyl)amino]-2-oxoethyl}piperazin-1-yl)benzoic acid
Compound characteristics
| Compound ID: | F290-0681 |
| Compound Name: | 5-[(methanesulfonyl)amino]-2-(4-{2-[(3-methoxypropyl)amino]-2-oxoethyl}piperazin-1-yl)benzoic acid |
| Molecular Weight: | 428.51 |
| Molecular Formula: | C18 H28 N4 O6 S |
| Smiles: | COCCCNC(CN1CCN(CC1)c1ccc(cc1C(O)=O)NS(C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.4183 |
| logD: | -1.6974 |
| logSw: | -2.3564 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 110.133 |
| InChI Key: | PFAFTJSAVGEDIY-UHFFFAOYSA-N |