ethyl {5-[2-(2-chloro-4-methylanilino)-2-oxoethyl]-7,8-dimethyl-4-oxo-4,5-dihydro-1H-1,5-benzodiazepin-2-yl}acetate
Chemical Structure Depiction of
ethyl {5-[2-(2-chloro-4-methylanilino)-2-oxoethyl]-7,8-dimethyl-4-oxo-4,5-dihydro-1H-1,5-benzodiazepin-2-yl}acetate
ethyl {5-[2-(2-chloro-4-methylanilino)-2-oxoethyl]-7,8-dimethyl-4-oxo-4,5-dihydro-1H-1,5-benzodiazepin-2-yl}acetate
Compound characteristics
| Compound ID: | F404-0351 |
| Compound Name: | ethyl {5-[2-(2-chloro-4-methylanilino)-2-oxoethyl]-7,8-dimethyl-4-oxo-4,5-dihydro-1H-1,5-benzodiazepin-2-yl}acetate |
| Molecular Weight: | 455.94 |
| Molecular Formula: | C24 H26 Cl N3 O4 |
| Smiles: | CCOC(CC1=CC(N(CC(Nc2ccc(C)cc2[Cl])=O)c2cc(C)c(C)cc2N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5505 |
| logD: | 4.222 |
| logSw: | -4.4213 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.186 |
| InChI Key: | AGWCRCQOQOABSC-UHFFFAOYSA-N |