2-(dipropylamino)-5-{[4-(2-methylpropyl)benzene-1-sulfonyl]amino}benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
2-(dipropylamino)-5-{[4-(2-methylpropyl)benzene-1-sulfonyl]amino}benzoic acid--trifluoroacetic acid (1/1)
2-(dipropylamino)-5-{[4-(2-methylpropyl)benzene-1-sulfonyl]amino}benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F294-0257 |
| Compound Name: | 2-(dipropylamino)-5-{[4-(2-methylpropyl)benzene-1-sulfonyl]amino}benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 546.61 |
| Molecular Formula: | C23 H32 N2 O4 S |
| Salt: | CF3COOH |
| Smiles: | CCCN(CCC)c1ccc(cc1C(O)=O)NS(c1ccc(CC(C)C)cc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.225 |
| logD: | 4.1093 |
| logSw: | -5.3716 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.239 |
| InChI Key: | WJDWFQLGBAHVOQ-UHFFFAOYSA-N |