5-[(5-chloro-2-methoxybenzene-1-sulfonyl)amino]-2-(dipropylamino)benzoic acid--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-[(5-chloro-2-methoxybenzene-1-sulfonyl)amino]-2-(dipropylamino)benzoic acid--trifluoroacetic acid (1/1)
5-[(5-chloro-2-methoxybenzene-1-sulfonyl)amino]-2-(dipropylamino)benzoic acid--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F294-0255 |
| Compound Name: | 5-[(5-chloro-2-methoxybenzene-1-sulfonyl)amino]-2-(dipropylamino)benzoic acid--trifluoroacetic acid (1/1) |
| Molecular Weight: | 554.97 |
| Molecular Formula: | C20 H25 Cl N2 O5 S |
| Salt: | CF3COOH |
| Smiles: | CCCN(CCC)c1ccc(cc1C(O)=O)NS(c1cc(ccc1OC)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8298 |
| logD: | 2.7142 |
| logSw: | -4.5913 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.869 |
| InChI Key: | QSPKIMZMRCQCDD-UHFFFAOYSA-N |