2-methyl-8-nitro-4-oxo-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-1-carbaldehyde
Chemical Structure Depiction of
2-methyl-8-nitro-4-oxo-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-1-carbaldehyde
2-methyl-8-nitro-4-oxo-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-1-carbaldehyde
Compound characteristics
| Compound ID: | 8010-3038 |
| Compound Name: | 2-methyl-8-nitro-4-oxo-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-1-carbaldehyde |
| Molecular Weight: | 249.22 |
| Molecular Formula: | C11 H11 N3 O4 |
| Smiles: | CC1CC(Nc2ccc(cc2N1C=O)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.6893 |
| logD: | -0.7488 |
| logSw: | -2.285 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.447 |
| InChI Key: | BYARTMJTIRRZNS-ZETCQYMHSA-N |