N-benzyl-3-[(6-tert-butyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)methyl]benzamide
Chemical Structure Depiction of
N-benzyl-3-[(6-tert-butyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)methyl]benzamide
N-benzyl-3-[(6-tert-butyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)methyl]benzamide
Compound characteristics
| Compound ID: | V020-9597 |
| Compound Name: | N-benzyl-3-[(6-tert-butyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)methyl]benzamide |
| Molecular Weight: | 428.53 |
| Molecular Formula: | C27 H28 N2 O3 |
| Smiles: | CC(C)(C)c1ccc2c(c1)N(Cc1cccc(c1)C(NCc1ccccc1)=O)C(CO2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8678 |
| logD: | 4.8677 |
| logSw: | -4.6497 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.482 |
| InChI Key: | SNZNXHIJZRGHMK-UHFFFAOYSA-N |