ethyl {7,8-dimethyl-4-oxo-5-[2-oxo-2-(3,4,5-trimethoxyanilino)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-(3,4,5-trimethoxyanilino)ethyl]-4,5-dihydro-1H-1,5-benzodiazepin-2-yl}acetate
ethyl {7,8-dimethyl-4-oxo-5-[2-oxo-2-(3,4,5-trimethoxyanilino)ethyl]-4,5-dihydro-1H-1,5-benzodiazepin-2-yl}acetate
Compound characteristics
| Compound ID: | F404-0347 |
| Compound Name: | ethyl {7,8-dimethyl-4-oxo-5-[2-oxo-2-(3,4,5-trimethoxyanilino)ethyl]-4,5-dihydro-1H-1,5-benzodiazepin-2-yl}acetate |
| Molecular Weight: | 497.55 |
| Molecular Formula: | C26 H31 N3 O7 |
| Smiles: | CCOC(CC1=CC(N(CC(Nc2cc(c(c(c2)OC)OC)OC)=O)c2cc(C)c(C)cc2N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2073 |
| logD: | 2.8787 |
| logSw: | -3.4763 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.862 |
| InChI Key: | VJMPRRKFDWDJMC-UHFFFAOYSA-N |