8',9'-dimethyl-1-(2,4,5-trimethylbenzene-1-sulfonyl)-5'H-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline]
Chemical Structure Depiction of
8',9'-dimethyl-1-(2,4,5-trimethylbenzene-1-sulfonyl)-5'H-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline]
8',9'-dimethyl-1-(2,4,5-trimethylbenzene-1-sulfonyl)-5'H-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline]
Compound characteristics
Compound ID: | F351-0943 |
Compound Name: | 8',9'-dimethyl-1-(2,4,5-trimethylbenzene-1-sulfonyl)-5'H-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline] |
Molecular Weight: | 449.61 |
Molecular Formula: | C26 H31 N3 O2 S |
Smiles: | [H]N1c2ccc(C)c(C)c2n2cccc2C12CCN(CC2)S(c1cc(C)c(C)cc1C)(=O)=O |
Stereo: | ACHIRAL |
logP: | 6.8299 |
logD: | 6.8286 |
logSw: | -5.7426 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 46.614 |
InChI Key: | GNRUUUVYUZOCKD-UHFFFAOYSA-N |