N-cyclopentyl-2,5-dimethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-cyclopentyl-2,5-dimethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
N-cyclopentyl-2,5-dimethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F482-0184 |
| Compound Name: | N-cyclopentyl-2,5-dimethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 539.57 |
| Molecular Formula: | C20 H31 N3 O5 S |
| Salt: | CF3COOH |
| Smiles: | COc1ccc(c(c1)S(N(CCC(N1CCNCC1)=O)C1CCCC1)(=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 1.1544 |
| logD: | 0.3265 |
| logSw: | -2.3808 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.497 |
| InChI Key: | KUJBDOIMXXVFJZ-UHFFFAOYSA-N |