1-[4-(4-{2-methyl-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]benzene-1-sulfonyl}piperazin-1-yl)phenyl]ethan-1-one
Chemical Structure Depiction of
1-[4-(4-{2-methyl-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]benzene-1-sulfonyl}piperazin-1-yl)phenyl]ethan-1-one
1-[4-(4-{2-methyl-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]benzene-1-sulfonyl}piperazin-1-yl)phenyl]ethan-1-one
Compound characteristics
Compound ID: | M086-0434 |
Compound Name: | 1-[4-(4-{2-methyl-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]benzene-1-sulfonyl}piperazin-1-yl)phenyl]ethan-1-one |
Molecular Weight: | 493.5 |
Molecular Formula: | C23 H22 F3 N3 O4 S |
Smiles: | CC(c1ccc(cc1)N1CCN(CC1)S(c1cc(ccc1C)c1cc(C(F)(F)F)on1)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.5395 |
logD: | 4.5395 |
logSw: | -4.2943 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 70.572 |
InChI Key: | DQNAHWYLNVHKAU-UHFFFAOYSA-N |