5-chloro-2-methoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-propylbenzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-chloro-2-methoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-propylbenzene-1-sulfonamide--trifluoroacetic acid (1/1)
5-chloro-2-methoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-propylbenzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F916-0572 |
| Compound Name: | 5-chloro-2-methoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-propylbenzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 503.92 |
| Molecular Formula: | C16 H24 Cl N3 O4 S |
| Salt: | CF3COOH |
| Smiles: | CCCN(CC(N1CCNCC1)=O)S(c1cc(ccc1OC)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0338 |
| logD: | 0.4743 |
| logSw: | -2.8048 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.576 |
| InChI Key: | KKJBOGXQCVOKLT-UHFFFAOYSA-N |