5-[(4-ethylbenzene-1-sulfonyl)amino]-2-(piperazin-1-yl)-N-propylbenzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-[(4-ethylbenzene-1-sulfonyl)amino]-2-(piperazin-1-yl)-N-propylbenzamide--trifluoroacetic acid (1/1)
5-[(4-ethylbenzene-1-sulfonyl)amino]-2-(piperazin-1-yl)-N-propylbenzamide--trifluoroacetic acid (1/1)
Compound characteristics
Compound ID: | L268-0527 |
Compound Name: | 5-[(4-ethylbenzene-1-sulfonyl)amino]-2-(piperazin-1-yl)-N-propylbenzamide--trifluoroacetic acid (1/1) |
Molecular Weight: | 544.59 |
Molecular Formula: | C22 H30 N4 O3 S |
Salt: | CF3COOH |
Smiles: | CCCNC(c1cc(ccc1N1CCNCC1)NS(c1ccc(CC)cc1)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.4201 |
logD: | 1.9446 |
logSw: | -3.9238 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 80.527 |
InChI Key: | PKKAQQWGVFKXGY-UHFFFAOYSA-N |