1-[4-({4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)benzoyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-[4-({4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)benzoyl]piperidine-4-carboxamide
1-[4-({4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)benzoyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C700-0450 |
| Compound Name: | 1-[4-({4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)benzoyl]piperidine-4-carboxamide |
| Molecular Weight: | 495.58 |
| Molecular Formula: | C30 H29 N3 O4 |
| Smiles: | Cc1cccc(CN2C(/C(=C\c3ccc(cc3)C(N3CCC(CC3)C(N)=O)=O)Oc3ccccc23)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.9529 |
| logD: | 3.9529 |
| logSw: | -4.0782 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.74 |
| InChI Key: | ONNXEWMNGCTQCW-UHFFFAOYSA-N |