4-[(2H-1,3-benzodioxol-5-yl)methyl]-6-tert-butyl-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
4-[(2H-1,3-benzodioxol-5-yl)methyl]-6-tert-butyl-2H-1,4-benzoxazin-3(4H)-one
4-[(2H-1,3-benzodioxol-5-yl)methyl]-6-tert-butyl-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | 8019-7517 |
| Compound Name: | 4-[(2H-1,3-benzodioxol-5-yl)methyl]-6-tert-butyl-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 339.39 |
| Molecular Formula: | C20 H21 N O4 |
| Smiles: | CC(C)(C)c1ccc2c(c1)N(Cc1ccc3c(c1)OCO3)C(CO2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2277 |
| logD: | 4.2277 |
| logSw: | -4.4165 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.184 |
| InChI Key: | MTLOGRFJMDHJMZ-UHFFFAOYSA-N |