ethyl {7,8-dimethyl-4-oxo-5-[2-oxo-2-(4-phenylpiperazin-1-yl)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-(4-phenylpiperazin-1-yl)ethyl]-4,5-dihydro-1H-1,5-benzodiazepin-2-yl}acetate
ethyl {7,8-dimethyl-4-oxo-5-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-4,5-dihydro-1H-1,5-benzodiazepin-2-yl}acetate
Compound characteristics
| Compound ID: | F404-0443 |
| Compound Name: | ethyl {7,8-dimethyl-4-oxo-5-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-4,5-dihydro-1H-1,5-benzodiazepin-2-yl}acetate |
| Molecular Weight: | 476.58 |
| Molecular Formula: | C27 H32 N4 O4 |
| Smiles: | CCOC(CC1=CC(N(CC(N2CCN(CC2)c2ccccc2)=O)c2cc(C)c(C)cc2N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3904 |
| logD: | 3.0618 |
| logSw: | -3.7462 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.388 |
| InChI Key: | QUJWXSCJYMHILA-UHFFFAOYSA-N |