3-[(3-methylbenzene-1-sulfonyl)amino]-4-(morpholin-4-yl)benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3-[(3-methylbenzene-1-sulfonyl)amino]-4-(morpholin-4-yl)benzoic acid--trifluoroacetic acid (1/1)
3-[(3-methylbenzene-1-sulfonyl)amino]-4-(morpholin-4-yl)benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F295-0783 |
| Compound Name: | 3-[(3-methylbenzene-1-sulfonyl)amino]-4-(morpholin-4-yl)benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 490.45 |
| Molecular Formula: | C18 H20 N2 O5 S |
| Salt: | CF3COOH |
| Smiles: | Cc1cccc(c1)S(Nc1cc(ccc1N1CCOCC1)C(O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1253 |
| logD: | 0.3865 |
| logSw: | -3.3019 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.658 |
| InChI Key: | CRAHCAJSDZSUEM-UHFFFAOYSA-N |