5-[(ethanesulfonyl)amino]-2-(4-methylpiperidin-1-yl)benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-[(ethanesulfonyl)amino]-2-(4-methylpiperidin-1-yl)benzoic acid--trifluoroacetic acid (1/1)
5-[(ethanesulfonyl)amino]-2-(4-methylpiperidin-1-yl)benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F294-0147 |
| Compound Name: | 5-[(ethanesulfonyl)amino]-2-(4-methylpiperidin-1-yl)benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 440.44 |
| Molecular Formula: | C15 H22 N2 O4 S |
| Salt: | CF3COOH |
| Smiles: | CCS(Nc1ccc(c(c1)C(O)=O)N1CCC(C)CC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0022 |
| logD: | 0.8865 |
| logSw: | -3.4998 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.346 |
| InChI Key: | MPQPUVGYTUGPKT-UHFFFAOYSA-N |