2-(morpholin-4-yl)-5-{[4-(propan-2-yl)benzene-1-sulfonyl]amino}benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
2-(morpholin-4-yl)-5-{[4-(propan-2-yl)benzene-1-sulfonyl]amino}benzoic acid--trifluoroacetic acid (1/1)
2-(morpholin-4-yl)-5-{[4-(propan-2-yl)benzene-1-sulfonyl]amino}benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F294-0768 |
| Compound Name: | 2-(morpholin-4-yl)-5-{[4-(propan-2-yl)benzene-1-sulfonyl]amino}benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 518.51 |
| Molecular Formula: | C20 H24 N2 O5 S |
| Salt: | CF3COOH |
| Smiles: | CC(C)c1ccc(cc1)S(Nc1ccc(c(c1)C(O)=O)N1CCOCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9454 |
| logD: | 1.8297 |
| logSw: | -3.8792 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.356 |
| InChI Key: | UHYNRSKZYKGVNM-UHFFFAOYSA-N |