ethyl (4-oxo-5-{2-oxo-2-[3-(propan-2-yl)anilino]ethyl}-4,5-dihydro-1H-1,5-benzodiazepin-2-yl)acetate
Chemical Structure Depiction of
ethyl (4-oxo-5-{2-oxo-2-[3-(propan-2-yl)anilino]ethyl}-4,5-dihydro-1H-1,5-benzodiazepin-2-yl)acetate
ethyl (4-oxo-5-{2-oxo-2-[3-(propan-2-yl)anilino]ethyl}-4,5-dihydro-1H-1,5-benzodiazepin-2-yl)acetate
Compound characteristics
| Compound ID: | F404-0632 |
| Compound Name: | ethyl (4-oxo-5-{2-oxo-2-[3-(propan-2-yl)anilino]ethyl}-4,5-dihydro-1H-1,5-benzodiazepin-2-yl)acetate |
| Molecular Weight: | 421.5 |
| Molecular Formula: | C24 H27 N3 O4 |
| Smiles: | CCOC(CC1=CC(N(CC(Nc2cccc(c2)C(C)C)=O)c2ccccc2N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2208 |
| logD: | 3.8593 |
| logSw: | -4.2104 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.884 |
| InChI Key: | QNATXAZFLAOZHP-UHFFFAOYSA-N |