ethyl (7,8-dimethyl-4-oxo-5-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}-4,5-dihydro-1H-1,5-benzodiazepin-2-yl)acetate
Chemical Structure Depiction of
ethyl (7,8-dimethyl-4-oxo-5-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}-4,5-dihydro-1H-1,5-benzodiazepin-2-yl)acetate
ethyl (7,8-dimethyl-4-oxo-5-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}-4,5-dihydro-1H-1,5-benzodiazepin-2-yl)acetate
Compound characteristics
| Compound ID: | F404-0344 |
| Compound Name: | ethyl (7,8-dimethyl-4-oxo-5-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}-4,5-dihydro-1H-1,5-benzodiazepin-2-yl)acetate |
| Molecular Weight: | 475.47 |
| Molecular Formula: | C24 H24 F3 N3 O4 |
| Smiles: | CCOC(CC1=CC(N(CC(Nc2cccc(c2)C(F)(F)F)=O)c2cc(C)c(C)cc2N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.87 |
| logD: | 4.5414 |
| logSw: | -4.5267 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.884 |
| InChI Key: | ZGTMRIXDSKCCNO-UHFFFAOYSA-N |