3-(3,5-di-tert-butyl-4-hydroxyphenyl)-N-{2-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-2-oxo-1-phenylethyl}propanamide
Chemical Structure Depiction of
3-(3,5-di-tert-butyl-4-hydroxyphenyl)-N-{2-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-2-oxo-1-phenylethyl}propanamide
3-(3,5-di-tert-butyl-4-hydroxyphenyl)-N-{2-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-2-oxo-1-phenylethyl}propanamide
Compound characteristics
| Compound ID: | C094-0205 |
| Compound Name: | 3-(3,5-di-tert-butyl-4-hydroxyphenyl)-N-{2-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-2-oxo-1-phenylethyl}propanamide |
| Molecular Weight: | 544.69 |
| Molecular Formula: | C33 H40 N2 O5 |
| Smiles: | CC(C)(C)c1cc(CCC(NC(C(Nc2ccc3c(c2)OCCO3)=O)c2ccccc2)=O)cc(c1O)C(C)(C)C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2558 |
| logD: | 5.2555 |
| logSw: | -4.8683 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.184 |
| InChI Key: | XKGNTWIEEGKCIT-GDLZYMKVSA-N |