3-[(1,3-benzothiazol-2-yl)amino]-6,6-dimethyl-1-(4-methylphenyl)-3-(trifluoromethyl)-3,5,6,7-tetrahydro-1H-indole-2,4-dione
Chemical Structure Depiction of
3-[(1,3-benzothiazol-2-yl)amino]-6,6-dimethyl-1-(4-methylphenyl)-3-(trifluoromethyl)-3,5,6,7-tetrahydro-1H-indole-2,4-dione
3-[(1,3-benzothiazol-2-yl)amino]-6,6-dimethyl-1-(4-methylphenyl)-3-(trifluoromethyl)-3,5,6,7-tetrahydro-1H-indole-2,4-dione
Compound characteristics
Compound ID: | 7591-0696 |
Compound Name: | 3-[(1,3-benzothiazol-2-yl)amino]-6,6-dimethyl-1-(4-methylphenyl)-3-(trifluoromethyl)-3,5,6,7-tetrahydro-1H-indole-2,4-dione |
Molecular Weight: | 485.53 |
Molecular Formula: | C25 H22 F3 N3 O2 S |
Smiles: | Cc1ccc(cc1)N1C2CC(C)(C)CC(C=2C(C1=O)(C(F)(F)F)Nc1nc2ccccc2s1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 5.8922 |
logD: | 5.8663 |
logSw: | -5.5207 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 49.294 |
InChI Key: | RUNWAJSXTUIHKP-DEOSSOPVSA-N |