ethyl {5-[2-(3-ethylanilino)-2-oxoethyl]-4-oxo-4,5-dihydro-1H-1,5-benzodiazepin-2-yl}acetate
Chemical Structure Depiction of
ethyl {5-[2-(3-ethylanilino)-2-oxoethyl]-4-oxo-4,5-dihydro-1H-1,5-benzodiazepin-2-yl}acetate
ethyl {5-[2-(3-ethylanilino)-2-oxoethyl]-4-oxo-4,5-dihydro-1H-1,5-benzodiazepin-2-yl}acetate
Compound characteristics
| Compound ID: | F404-0163 |
| Compound Name: | ethyl {5-[2-(3-ethylanilino)-2-oxoethyl]-4-oxo-4,5-dihydro-1H-1,5-benzodiazepin-2-yl}acetate |
| Molecular Weight: | 407.47 |
| Molecular Formula: | C23 H25 N3 O4 |
| Smiles: | CCc1cccc(c1)NC(CN1C(C=C(CC(=O)OCC)Nc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6615 |
| logD: | 3.3 |
| logSw: | -3.911 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.884 |
| InChI Key: | NELHEXSFYBAFGS-UHFFFAOYSA-N |