2-methyl-7-{4-[3-(trifluoromethyl)phenyl]piperazine-1-sulfonyl}-2,3-dihydro[1,4]thiazino[2,3,4-hi]indol-5(6H)-one
Chemical Structure Depiction of
2-methyl-7-{4-[3-(trifluoromethyl)phenyl]piperazine-1-sulfonyl}-2,3-dihydro[1,4]thiazino[2,3,4-hi]indol-5(6H)-one
2-methyl-7-{4-[3-(trifluoromethyl)phenyl]piperazine-1-sulfonyl}-2,3-dihydro[1,4]thiazino[2,3,4-hi]indol-5(6H)-one
Compound characteristics
| Compound ID: | E589-4207 |
| Compound Name: | 2-methyl-7-{4-[3-(trifluoromethyl)phenyl]piperazine-1-sulfonyl}-2,3-dihydro[1,4]thiazino[2,3,4-hi]indol-5(6H)-one |
| Molecular Weight: | 497.56 |
| Molecular Formula: | C22 H22 F3 N3 O3 S2 |
| Smiles: | CC1CN2C(Cc3c(ccc(c23)S1)S(N1CCN(CC1)c1cccc(c1)C(F)(F)F)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9536 |
| logD: | 3.9528 |
| logSw: | -4.1882 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.746 |
| InChI Key: | BUKVLGSCBHQXOY-CQSZACIVSA-N |