2-(azepan-1-yl)-5-(4-fluorobenzamido)benzoic acid
Chemical Structure Depiction of
2-(azepan-1-yl)-5-(4-fluorobenzamido)benzoic acid
2-(azepan-1-yl)-5-(4-fluorobenzamido)benzoic acid
Compound characteristics
| Compound ID: | G889-0272 |
| Compound Name: | 2-(azepan-1-yl)-5-(4-fluorobenzamido)benzoic acid |
| Molecular Weight: | 470.42 |
| Molecular Formula: | C20 H21 F N2 O3 |
| Salt: | CF3COOH |
| Smiles: | C1CCCN(CC1)c1ccc(cc1C(O)=O)NC(c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3787 |
| logD: | 2.1281 |
| logSw: | -4.1682 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.22 |
| InChI Key: | YFXJYYCDFHSFEY-UHFFFAOYSA-N |