1-(4-{4-[1,2,5-trimethyl-4-(piperidine-1-carbonyl)-1H-pyrrole-3-sulfonyl]piperazin-1-yl}phenyl)ethan-1-one
Chemical Structure Depiction of
1-(4-{4-[1,2,5-trimethyl-4-(piperidine-1-carbonyl)-1H-pyrrole-3-sulfonyl]piperazin-1-yl}phenyl)ethan-1-one
1-(4-{4-[1,2,5-trimethyl-4-(piperidine-1-carbonyl)-1H-pyrrole-3-sulfonyl]piperazin-1-yl}phenyl)ethan-1-one
Compound characteristics
Compound ID: | G243-0525 |
Compound Name: | 1-(4-{4-[1,2,5-trimethyl-4-(piperidine-1-carbonyl)-1H-pyrrole-3-sulfonyl]piperazin-1-yl}phenyl)ethan-1-one |
Molecular Weight: | 486.63 |
Molecular Formula: | C25 H34 N4 O4 S |
Smiles: | CC(c1ccc(cc1)N1CCN(CC1)S(c1c(C(N2CCCCC2)=O)c(C)n(C)c1C)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 1.9263 |
logD: | 1.9263 |
logSw: | -2.4602 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 68.464 |
InChI Key: | LBVPATOYLZUWTE-UHFFFAOYSA-N |