methyl 2-[(3,5-di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino]benzoate
Chemical Structure Depiction of
methyl 2-[(3,5-di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino]benzoate
methyl 2-[(3,5-di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino]benzoate
Compound characteristics
| Compound ID: | 5507-0014 |
| Compound Name: | methyl 2-[(3,5-di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino]benzoate |
| Molecular Weight: | 353.46 |
| Molecular Formula: | C22 H27 N O3 |
| Smiles: | CC(C)(C)C1=CC(C=C(C1=O)C(C)(C)C)=Nc1ccccc1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 5.8611 |
| logD: | 5.8505 |
| logSw: | -5.6848 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.259 |
| InChI Key: | VHBTZDSTAVKXHP-UHFFFAOYSA-N |