3-{2-oxo-2-[8-(trifluoromethoxy)-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl]ethyl}-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione
Chemical Structure Depiction of
3-{2-oxo-2-[8-(trifluoromethoxy)-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl]ethyl}-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione
3-{2-oxo-2-[8-(trifluoromethoxy)-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl]ethyl}-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione
Compound characteristics
| Compound ID: | Y042-2401 |
| Compound Name: | 3-{2-oxo-2-[8-(trifluoromethoxy)-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl]ethyl}-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione |
| Molecular Weight: | 472.42 |
| Molecular Formula: | C23 H19 F3 N4 O4 |
| Smiles: | C1CN(Cc2c3cc(ccc3[nH]c12)OC(F)(F)F)C(CC1C(Nc2ccccc2C(N1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6805 |
| logD: | 2.6681 |
| logSw: | -3.5321 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 83.792 |
| InChI Key: | KTNSPABWWPYHRI-IBGZPJMESA-N |