2-(6-tert-butyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]acetamide
Chemical Structure Depiction of
2-(6-tert-butyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]acetamide
2-(6-tert-butyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]acetamide
Compound characteristics
| Compound ID: | K786-3364 |
| Compound Name: | 2-(6-tert-butyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]acetamide |
| Molecular Weight: | 435.57 |
| Molecular Formula: | C26 H33 N3 O3 |
| Smiles: | CC(C)(C)c1ccc2c(c1)N(CC(NCCCN1CCc3ccccc3C1)=O)C(CO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4332 |
| logD: | 2.2292 |
| logSw: | -3.6763 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.026 |
| InChI Key: | KKPZIUTZDDMTFO-UHFFFAOYSA-N |