tert-butyl 8-[(3-methoxyphenyl)methyl]-4-oxo-8-azabicyclo[3.2.1]oct-2-ene-6-carboxylate
Chemical Structure Depiction of
tert-butyl 8-[(3-methoxyphenyl)methyl]-4-oxo-8-azabicyclo[3.2.1]oct-2-ene-6-carboxylate
tert-butyl 8-[(3-methoxyphenyl)methyl]-4-oxo-8-azabicyclo[3.2.1]oct-2-ene-6-carboxylate
Compound characteristics
| Compound ID: | 8017-3572 |
| Compound Name: | tert-butyl 8-[(3-methoxyphenyl)methyl]-4-oxo-8-azabicyclo[3.2.1]oct-2-ene-6-carboxylate |
| Molecular Weight: | 343.42 |
| Molecular Formula: | C20 H25 N O4 |
| Smiles: | CC(C)(C)OC(C1CC2C=CC(C1N2Cc1cccc(c1)OC)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.3424 |
| logD: | 2.9988 |
| logSw: | -3.6919 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 43.477 |
| InChI Key: | XHKRZZKPVOIIPD-UHFFFAOYSA-N |