N-(3-methoxypropyl)-2,4,6-trimethyl-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-(3-methoxypropyl)-2,4,6-trimethyl-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
N-(3-methoxypropyl)-2,4,6-trimethyl-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F916-0582 |
| Compound Name: | N-(3-methoxypropyl)-2,4,6-trimethyl-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 511.56 |
| Molecular Formula: | C19 H31 N3 O4 S |
| Salt: | CF3COOH |
| Smiles: | Cc1cc(C)c(c(C)c1)S(N(CCCOC)CC(N1CCNCC1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3873 |
| logD: | 0.8278 |
| logSw: | -2.1151 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.288 |
| InChI Key: | BGLWJRCUKBDFFW-UHFFFAOYSA-N |