N-{2-[(2H-1,3-benzodioxol-5-yl)amino]-1-(4-methoxyphenyl)-2-oxoethyl}-3-(3,5-di-tert-butyl-4-hydroxyphenyl)propanamide
Chemical Structure Depiction of
N-{2-[(2H-1,3-benzodioxol-5-yl)amino]-1-(4-methoxyphenyl)-2-oxoethyl}-3-(3,5-di-tert-butyl-4-hydroxyphenyl)propanamide
N-{2-[(2H-1,3-benzodioxol-5-yl)amino]-1-(4-methoxyphenyl)-2-oxoethyl}-3-(3,5-di-tert-butyl-4-hydroxyphenyl)propanamide
Compound characteristics
| Compound ID: | C094-0202 |
| Compound Name: | N-{2-[(2H-1,3-benzodioxol-5-yl)amino]-1-(4-methoxyphenyl)-2-oxoethyl}-3-(3,5-di-tert-butyl-4-hydroxyphenyl)propanamide |
| Molecular Weight: | 560.69 |
| Molecular Formula: | C33 H40 N2 O6 |
| Smiles: | CC(C)(C)c1cc(CCC(NC(C(Nc2ccc3c(c2)OCO3)=O)c2ccc(cc2)OC)=O)cc(c1O)C(C)(C)C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0944 |
| logD: | 6.0942 |
| logSw: | -5.4068 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 87.02 |
| InChI Key: | DFGJHIDKRBUITE-GDLZYMKVSA-N |