5-chloro-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-propylthiophene-2-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-chloro-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-propylthiophene-2-sulfonamide--trifluoroacetic acid (1/1)
5-chloro-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-propylthiophene-2-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F482-0844 |
| Compound Name: | 5-chloro-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-propylthiophene-2-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 493.95 |
| Molecular Formula: | C14 H22 Cl N3 O3 S2 |
| Salt: | CF3COOH |
| Smiles: | CCCN(CCC(N1CCNCC1)=O)S(c1ccc(s1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3394 |
| logD: | 0.5114 |
| logSw: | -2.7154 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.942 |
| InChI Key: | MDEDFACLVWTWOZ-UHFFFAOYSA-N |