4-({4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)-N-{3-[(propan-2-yl)oxy]propyl}benzamide
Chemical Structure Depiction of
4-({4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)-N-{3-[(propan-2-yl)oxy]propyl}benzamide
4-({4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)-N-{3-[(propan-2-yl)oxy]propyl}benzamide
Compound characteristics
| Compound ID: | K788-5749 |
| Compound Name: | 4-({4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)-N-{3-[(propan-2-yl)oxy]propyl}benzamide |
| Molecular Weight: | 484.6 |
| Molecular Formula: | C30 H32 N2 O4 |
| Smiles: | CC(C)OCCCNC(c1ccc(\C=C2/C(N(Cc3ccc(C)cc3)c3ccccc3O2)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1012 |
| logD: | 5.1012 |
| logSw: | -4.8267 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.76 |
| InChI Key: | XQKZFCPRSXMZLW-UHFFFAOYSA-N |