4-[(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene)methyl]-N-[3-(pyrrolidin-1-yl)propyl]benzamide
Chemical Structure Depiction of
4-[(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene)methyl]-N-[3-(pyrrolidin-1-yl)propyl]benzamide
4-[(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene)methyl]-N-[3-(pyrrolidin-1-yl)propyl]benzamide
Compound characteristics
| Compound ID: | K788-4798 |
| Compound Name: | 4-[(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene)methyl]-N-[3-(pyrrolidin-1-yl)propyl]benzamide |
| Molecular Weight: | 391.47 |
| Molecular Formula: | C23 H25 N3 O3 |
| Smiles: | C1CCN(C1)CCCNC(c1ccc(/C=C2/C(Nc3ccccc3O2)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8259 |
| logD: | -0.2066 |
| logSw: | -3.4773 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.411 |
| InChI Key: | ZIQVSVGQRIBWED-UHFFFAOYSA-N |