ethyl {4-oxo-5-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]-4,5-dihydro-1H-1,5-benzodiazepin-2-yl}acetate
Chemical Structure Depiction of
ethyl {4-oxo-5-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]-4,5-dihydro-1H-1,5-benzodiazepin-2-yl}acetate
ethyl {4-oxo-5-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]-4,5-dihydro-1H-1,5-benzodiazepin-2-yl}acetate
Compound characteristics
| Compound ID: | F404-0165 |
| Compound Name: | ethyl {4-oxo-5-[2-oxo-2-(2,4,6-trimethylanilino)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(Nc2c(C)cc(C)cc2C)=O)c2ccccc2N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3843 |
| logD: | 3.0228 |
| logSw: | -3.6965 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.489 |
| InChI Key: | QWURHDIKYBHBQP-UHFFFAOYSA-N |