4-methoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-pentylbenzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-methoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-pentylbenzene-1-sulfonamide--trifluoroacetic acid (1/1)
4-methoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-pentylbenzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F916-0376 |
| Compound Name: | 4-methoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-pentylbenzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 497.53 |
| Molecular Formula: | C18 H29 N3 O4 S |
| Salt: | CF3COOH |
| Smiles: | CCCCCN(CC(N1CCNCC1)=O)S(c1ccc(cc1)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8127 |
| logD: | 1.2532 |
| logSw: | -2.6701 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.489 |
| InChI Key: | VBVSYJDIKLMVBD-UHFFFAOYSA-N |