ethyl 4-(1,5-dimethyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-7-sulfonyl)piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-(1,5-dimethyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-7-sulfonyl)piperazine-1-carboxylate
ethyl 4-(1,5-dimethyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-7-sulfonyl)piperazine-1-carboxylate
Compound characteristics
| Compound ID: | E138-0063 |
| Compound Name: | ethyl 4-(1,5-dimethyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-7-sulfonyl)piperazine-1-carboxylate |
| Molecular Weight: | 424.47 |
| Molecular Formula: | C18 H24 N4 O6 S |
| Smiles: | CCOC(N1CCN(CC1)S(c1ccc2c(c1)N(C)C(CC(N2C)=O)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.4445 |
| logD: | 0.4445 |
| logSw: | -2.3053 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 85.975 |
| InChI Key: | JLXOCAILKFKVQA-UHFFFAOYSA-N |