5-(4-chlorobenzamido)-2-{4-[2-(morpholin-4-yl)ethyl]piperidin-1-yl}benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-(4-chlorobenzamido)-2-{4-[2-(morpholin-4-yl)ethyl]piperidin-1-yl}benzoic acid--trifluoroacetic acid (1/1)
5-(4-chlorobenzamido)-2-{4-[2-(morpholin-4-yl)ethyl]piperidin-1-yl}benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | G889-1162 |
| Compound Name: | 5-(4-chlorobenzamido)-2-{4-[2-(morpholin-4-yl)ethyl]piperidin-1-yl}benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 586.01 |
| Molecular Formula: | C25 H30 Cl N3 O4 |
| Salt: | CF3COOH |
| Smiles: | C(CN1CCOCC1)C1CCN(CC1)c1ccc(cc1C(O)=O)NC(c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.4046 |
| logD: | 2.1539 |
| logSw: | -4.4956 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.509 |
| InChI Key: | BNTLTBFWLRDRLF-UHFFFAOYSA-N |