methyl N-benzoyl-O-(3-nitrobenzoyl)tyrosinate
Chemical Structure Depiction of
methyl N-benzoyl-O-(3-nitrobenzoyl)tyrosinate
methyl N-benzoyl-O-(3-nitrobenzoyl)tyrosinate
Compound characteristics
| Compound ID: | 8005-5909 |
| Compound Name: | methyl N-benzoyl-O-(3-nitrobenzoyl)tyrosinate |
| Molecular Weight: | 448.43 |
| Molecular Formula: | C24 H20 N2 O7 |
| Smiles: | COC(C(Cc1ccc(cc1)OC(c1cccc(c1)[N+]([O-])=O)=O)NC(c1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3365 |
| logD: | 3.3365 |
| logSw: | -3.8387 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 99.215 |
| InChI Key: | QHNLEMNIGRWAGE-NRFANRHFSA-N |